USER MOD reduce.3.24.130724 H: found=0, std=0, add=1076, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1066 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 104 CYS SG : rot -94:sc= 0.897 USER MOD Set 1.2: A 105 CYS SG : rot 64:sc= -0.129 USER MOD Set 1.3: A 108 CYS SG : rot -22:sc= 0.955 USER MOD Set 1.4: A 120 CYS SG : rot -124:sc= -0.991 USER MOD Set 1.5: A 122 CYS SG : rot 87:sc= 1.01 USER MOD Set 1.6: A 145 CYS SG : rot -136:sc= 0.487 USER MOD Set 1.7: A 147 HIS : no HD1:sc= -1.4 K(o=1.4,f=5.4) USER MOD Set 1.8: A 148 CYS SG : rot -103:sc= -0.866 USER MOD Set 1.9: A 150 CYS SG : rot -158:sc= 0.0545 USER MOD Set 1.10: A 153 CYS SG : rot 23:sc= 1.35 USER MOD Set 2.1: A 94 LYS NZ :NH3+ 174:sc= 0 (180deg=0) USER MOD Set 2.2: A 100 TYR OH : rot 180:sc= -0.0186 USER MOD Set 2.3: A 110 GLN : amide:sc= -0.228 K(o=-0.25,f=-3!) USER MOD Set 3.1: A 22 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 62 TYR OH : rot 180:sc= -2.36! USER MOD Set 4.1: A 56 HIS : no HE2:sc= -3.8! C(o=-3.8!,f=-8.2!) USER MOD Set 4.2: A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 174:sc= 0.282 (180deg=0.271) USER MOD Single : A 24 THR OG1 : rot 77:sc= -1.07 USER MOD Single : A 29 GLN : amide:sc= -1.65! C(o=-1.7!,f=-4.9!) USER MOD Single : A 34 GLN : amide:sc= -0.0131 K(o=-0.013,f=-0.87) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 46 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 GLN : amide:sc= -0.327 X(o=-0.33,f=-0.33) USER MOD Single : A 53 MET CE :methyl -135:sc= -3.85 (180deg=-6.79!) USER MOD Single : A 54 GLN : amide:sc=-0.00759 K(o=-0.0076,f=-1.6!) USER MOD Single : A 57 HIS : no HD1:sc= -5.45! C(o=-5.4!,f=-6.7!) USER MOD Single : A 58 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 60 SER OG : rot -29:sc= 0.687 USER MOD Single : A 64 TYR OH : rot 180:sc= -1.47! USER MOD Single : A 65 THR OG1 : rot 102:sc= 0.998 USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 175:sc= 0.919 (180deg=0.793) USER MOD Single : A 86 TYR OH : rot 148:sc= 1.22 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 THR OG1 : rot 6:sc= 0.768 USER MOD Single : A 128 GLN : amide:sc= -3.35 K(o=-3.3,f=-10!) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 THR OG1 : rot 180:sc= -0.0178 USER MOD Single : A 139 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 143 HIS : no HD1:sc= -0.562 K(o=-0.56,f=-0.032) USER MOD Single : A 144 GLN : amide:sc= -0.1 X(o=-0.1,f=0) USER MOD Single : A 155 SER OG : rot 180:sc= 0.109 USER MOD ----------------------------------------------------------------- ATOM 216 N ALA A 12 -15.554 -7.541 18.261 1.00 0.00 N ATOM 217 CA ALA A 12 -14.066 -7.410 18.505 1.00 0.00 C ATOM 218 C ALA A 12 -13.772 -7.457 20.015 1.00 0.00 C ATOM 219 O ALA A 12 -14.588 -7.032 20.810 1.00 0.00 O ATOM 220 CB ALA A 12 -13.630 -6.050 17.924 1.00 0.00 C ATOM 0 HA ALA A 12 -13.522 -8.227 18.032 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -12.560 -5.914 18.079 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -13.848 -6.024 16.856 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -14.174 -5.249 18.425 1.00 0.00 H new ATOM 226 N PRO A 13 -12.619 -7.981 20.373 1.00 0.00 N ATOM 227 CA PRO A 13 -12.251 -8.079 21.809 1.00 0.00 C ATOM 228 C PRO A 13 -11.946 -6.692 22.390 1.00 0.00 C ATOM 229 O PRO A 13 -11.678 -5.755 21.663 1.00 0.00 O ATOM 230 CB PRO A 13 -11.001 -8.957 21.804 1.00 0.00 C ATOM 231 CG PRO A 13 -10.415 -8.787 20.440 1.00 0.00 C ATOM 232 CD PRO A 13 -11.562 -8.522 19.501 1.00 0.00 C ATOM 0 HA PRO A 13 -13.051 -8.490 22.424 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -10.298 -8.647 22.577 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -11.250 -10.000 21.999 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -9.705 -7.960 20.425 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -9.869 -9.681 20.140 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -11.284 -7.811 18.722 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -11.886 -9.434 19.000 1.00 0.00 H new ATOM 240 N ASP A 14 -11.992 -6.553 23.702 1.00 0.00 N ATOM 241 CA ASP A 14 -11.707 -5.207 24.337 1.00 0.00 C ATOM 242 C ASP A 14 -10.412 -4.584 23.778 1.00 0.00 C ATOM 243 O ASP A 14 -10.301 -3.377 23.676 1.00 0.00 O ATOM 244 CB ASP A 14 -11.553 -5.461 25.845 1.00 0.00 C ATOM 245 CG ASP A 14 -11.765 -4.151 26.607 1.00 0.00 C ATOM 246 OD1 ASP A 14 -10.912 -3.284 26.506 1.00 0.00 O ATOM 247 OD2 ASP A 14 -12.777 -4.036 27.278 1.00 0.00 O ATOM 0 H ASP A 14 -12.212 -7.303 24.358 1.00 0.00 H new ATOM 0 HA ASP A 14 -12.516 -4.508 24.122 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -12.276 -6.207 26.175 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -10.562 -5.862 26.058 1.00 0.00 H new ATOM 252 N GLY A 15 -9.434 -5.390 23.411 1.00 0.00 N ATOM 253 CA GLY A 15 -8.159 -4.833 22.857 1.00 0.00 C ATOM 254 C GLY A 15 -8.449 -3.868 21.689 1.00 0.00 C ATOM 255 O GLY A 15 -7.736 -2.901 21.498 1.00 0.00 O ATOM 0 H GLY A 15 -9.469 -6.408 23.473 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -7.614 -4.309 23.642 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -7.520 -5.646 22.513 1.00 0.00 H new ATOM 259 N PHE A 16 -9.486 -4.114 20.905 1.00 0.00 N ATOM 260 CA PHE A 16 -9.792 -3.182 19.756 1.00 0.00 C ATOM 261 C PHE A 16 -9.948 -1.735 20.256 1.00 0.00 C ATOM 262 O PHE A 16 -9.586 -0.801 19.567 1.00 0.00 O ATOM 263 CB PHE A 16 -11.112 -3.667 19.126 1.00 0.00 C ATOM 264 CG PHE A 16 -11.404 -2.881 17.864 1.00 0.00 C ATOM 265 CD1 PHE A 16 -10.397 -2.672 16.908 1.00 0.00 C ATOM 266 CD2 PHE A 16 -12.687 -2.363 17.649 1.00 0.00 C ATOM 267 CE1 PHE A 16 -10.675 -1.946 15.744 1.00 0.00 C ATOM 268 CE2 PHE A 16 -12.964 -1.637 16.484 1.00 0.00 C ATOM 269 CZ PHE A 16 -11.958 -1.428 15.532 1.00 0.00 C ATOM 0 H PHE A 16 -10.122 -4.904 21.008 1.00 0.00 H new ATOM 0 HA PHE A 16 -8.980 -3.191 19.029 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -11.045 -4.730 18.895 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -11.930 -3.546 19.837 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -9.407 -3.072 17.071 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -13.464 -2.523 18.382 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -9.900 -1.786 15.010 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -13.954 -1.238 16.319 1.00 0.00 H new ATOM 0 HZ PHE A 16 -12.172 -0.867 14.634 1.00 0.00 H new ATOM 279 N GLU A 17 -10.480 -1.536 21.448 1.00 0.00 N ATOM 280 CA GLU A 17 -10.641 -0.127 21.970 1.00 0.00 C ATOM 281 C GLU A 17 -9.288 0.606 21.950 1.00 0.00 C ATOM 282 O GLU A 17 -9.226 1.786 21.657 1.00 0.00 O ATOM 283 CB GLU A 17 -11.156 -0.243 23.414 1.00 0.00 C ATOM 284 CG GLU A 17 -11.772 1.089 23.845 1.00 0.00 C ATOM 285 CD GLU A 17 -11.790 1.175 25.373 1.00 0.00 C ATOM 286 OE1 GLU A 17 -10.736 1.020 25.967 1.00 0.00 O ATOM 287 OE2 GLU A 17 -12.857 1.392 25.921 1.00 0.00 O ATOM 0 H GLU A 17 -10.805 -2.273 22.074 1.00 0.00 H new ATOM 0 HA GLU A 17 -11.335 0.440 21.350 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -11.898 -1.038 23.484 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -10.338 -0.511 24.083 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -11.198 1.918 23.431 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -12.786 1.176 23.454 1.00 0.00 H new ATOM 294 N LYS A 18 -8.204 -0.082 22.249 1.00 0.00 N ATOM 295 CA LYS A 18 -6.857 0.598 22.232 1.00 0.00 C ATOM 296 C LYS A 18 -6.582 1.205 20.844 1.00 0.00 C ATOM 297 O LYS A 18 -5.985 2.260 20.737 1.00 0.00 O ATOM 298 CB LYS A 18 -5.809 -0.480 22.552 1.00 0.00 C ATOM 299 CG LYS A 18 -5.883 -0.837 24.038 1.00 0.00 C ATOM 300 CD LYS A 18 -5.512 -2.310 24.230 1.00 0.00 C ATOM 301 CE LYS A 18 -4.021 -2.424 24.555 1.00 0.00 C ATOM 302 NZ LYS A 18 -3.935 -3.479 25.602 1.00 0.00 N ATOM 0 H LYS A 18 -8.190 -1.070 22.501 1.00 0.00 H new ATOM 0 HA LYS A 18 -6.823 1.408 22.961 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -5.987 -1.367 21.944 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -4.811 -0.118 22.303 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -5.205 -0.203 24.609 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -6.888 -0.652 24.418 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -6.105 -2.743 25.036 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -5.742 -2.875 23.326 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -3.444 -2.697 23.671 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -3.622 -1.476 24.916 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -2.941 -3.615 25.877 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -4.488 -3.189 26.434 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -4.316 -4.372 25.228 1.00 0.00 H new ATOM 316 N ILE A 19 -7.019 0.557 19.782 1.00 0.00 N ATOM 317 CA ILE A 19 -6.781 1.119 18.413 1.00 0.00 C ATOM 318 C ILE A 19 -8.122 1.487 17.744 1.00 0.00 C ATOM 319 O ILE A 19 -8.289 1.313 16.551 1.00 0.00 O ATOM 320 CB ILE A 19 -6.050 0.012 17.627 1.00 0.00 C ATOM 321 CG1 ILE A 19 -6.933 -1.244 17.502 1.00 0.00 C ATOM 322 CG2 ILE A 19 -4.746 -0.360 18.347 1.00 0.00 C ATOM 323 CD1 ILE A 19 -6.752 -1.875 16.116 1.00 0.00 C ATOM 0 H ILE A 19 -7.525 -0.328 19.807 1.00 0.00 H new ATOM 0 HA ILE A 19 -6.188 2.033 18.445 1.00 0.00 H new ATOM 0 HB ILE A 19 -5.830 0.390 16.629 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -6.668 -1.964 18.276 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -7.979 -0.980 17.657 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -4.232 -1.143 17.788 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -4.104 0.518 18.414 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -4.974 -0.720 19.350 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -7.380 -2.763 16.036 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -7.040 -1.156 15.349 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -5.708 -2.155 15.977 1.00 0.00 H new ATOM 335 N LYS A 20 -9.084 1.978 18.504 1.00 0.00 N ATOM 336 CA LYS A 20 -10.420 2.334 17.895 1.00 0.00 C ATOM 337 C LYS A 20 -10.459 3.756 17.277 1.00 0.00 C ATOM 338 O LYS A 20 -11.030 3.922 16.218 1.00 0.00 O ATOM 339 CB LYS A 20 -11.449 2.221 19.036 1.00 0.00 C ATOM 340 CG LYS A 20 -12.860 2.500 18.500 1.00 0.00 C ATOM 341 CD LYS A 20 -13.239 1.445 17.456 1.00 0.00 C ATOM 342 CE LYS A 20 -13.025 2.011 16.049 1.00 0.00 C ATOM 343 NZ LYS A 20 -14.038 1.323 15.200 1.00 0.00 N ATOM 0 H LYS A 20 -9.005 2.146 19.507 1.00 0.00 H new ATOM 0 HA LYS A 20 -10.633 1.658 17.067 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -11.409 1.224 19.476 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -11.205 2.929 19.828 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -13.579 2.488 19.319 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -12.900 3.495 18.056 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -12.634 0.549 17.594 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -14.280 1.149 17.585 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -13.165 3.092 16.033 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -12.013 1.815 15.694 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -14.023 1.730 14.243 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -13.816 0.308 15.148 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -14.983 1.449 15.616 1.00 0.00 H new ATOM 357 N PRO A 21 -9.901 4.748 17.949 1.00 0.00 N ATOM 358 CA PRO A 21 -9.963 6.133 17.408 1.00 0.00 C ATOM 359 C PRO A 21 -8.990 6.335 16.234 1.00 0.00 C ATOM 360 O PRO A 21 -9.306 7.036 15.291 1.00 0.00 O ATOM 361 CB PRO A 21 -9.575 7.006 18.596 1.00 0.00 C ATOM 362 CG PRO A 21 -8.761 6.127 19.487 1.00 0.00 C ATOM 363 CD PRO A 21 -9.176 4.699 19.228 1.00 0.00 C ATOM 0 HA PRO A 21 -10.947 6.373 17.006 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -9.003 7.876 18.274 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -10.458 7.380 19.114 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -7.698 6.259 19.286 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -8.922 6.388 20.533 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -8.310 4.040 19.168 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -9.811 4.319 20.029 1.00 0.00 H new ATOM 371 N THR A 22 -7.815 5.742 16.275 1.00 0.00 N ATOM 372 CA THR A 22 -6.849 5.942 15.132 1.00 0.00 C ATOM 373 C THR A 22 -7.458 5.413 13.827 1.00 0.00 C ATOM 374 O THR A 22 -7.364 6.053 12.796 1.00 0.00 O ATOM 375 CB THR A 22 -5.571 5.162 15.480 1.00 0.00 C ATOM 376 OG1 THR A 22 -5.069 5.615 16.730 1.00 0.00 O ATOM 377 CG2 THR A 22 -4.519 5.389 14.392 1.00 0.00 C ATOM 0 H THR A 22 -7.485 5.141 17.030 1.00 0.00 H new ATOM 0 HA THR A 22 -6.628 7.000 14.989 1.00 0.00 H new ATOM 0 HB THR A 22 -5.799 4.098 15.543 1.00 0.00 H new ATOM 0 HG1 THR A 22 -4.255 5.118 16.955 1.00 0.00 H new ATOM 0 HG21 THR A 22 -3.614 4.835 14.640 1.00 0.00 H new ATOM 0 HG22 THR A 22 -4.906 5.042 13.434 1.00 0.00 H new ATOM 0 HG23 THR A 22 -4.288 6.452 14.326 1.00 0.00 H new ATOM 385 N LEU A 23 -8.084 4.258 13.857 1.00 0.00 N ATOM 386 CA LEU A 23 -8.698 3.714 12.593 1.00 0.00 C ATOM 387 C LEU A 23 -9.837 4.635 12.137 1.00 0.00 C ATOM 388 O LEU A 23 -9.985 4.901 10.958 1.00 0.00 O ATOM 389 CB LEU A 23 -9.238 2.315 12.925 1.00 0.00 C ATOM 390 CG LEU A 23 -8.069 1.390 13.267 1.00 0.00 C ATOM 391 CD1 LEU A 23 -8.579 0.177 14.049 1.00 0.00 C ATOM 392 CD2 LEU A 23 -7.397 0.922 11.973 1.00 0.00 C ATOM 0 H LEU A 23 -8.197 3.674 14.686 1.00 0.00 H new ATOM 0 HA LEU A 23 -7.967 3.660 11.786 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -9.931 2.370 13.765 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -9.796 1.917 12.077 1.00 0.00 H new ATOM 0 HG LEU A 23 -7.347 1.931 13.879 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -7.742 -0.479 14.290 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -9.055 0.512 14.971 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -9.304 -0.367 13.444 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -6.563 0.262 12.214 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -8.121 0.383 11.361 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -7.028 1.787 11.421 1.00 0.00 H new ATOM 404 N THR A 24 -10.638 5.141 13.056 1.00 0.00 N ATOM 405 CA THR A 24 -11.758 6.062 12.641 1.00 0.00 C ATOM 406 C THR A 24 -11.196 7.275 11.877 1.00 0.00 C ATOM 407 O THR A 24 -11.824 7.776 10.964 1.00 0.00 O ATOM 408 CB THR A 24 -12.461 6.523 13.929 1.00 0.00 C ATOM 409 OG1 THR A 24 -12.334 5.513 14.921 1.00 0.00 O ATOM 410 CG2 THR A 24 -13.942 6.776 13.641 1.00 0.00 C ATOM 0 H THR A 24 -10.568 4.961 14.057 1.00 0.00 H new ATOM 0 HA THR A 24 -12.456 5.550 11.979 1.00 0.00 H new ATOM 0 HB THR A 24 -12.001 7.444 14.286 1.00 0.00 H new ATOM 0 HG1 THR A 24 -11.431 5.539 15.301 1.00 0.00 H new ATOM 0 HG21 THR A 24 -14.440 7.103 14.554 1.00 0.00 H new ATOM 0 HG22 THR A 24 -14.038 7.550 12.879 1.00 0.00 H new ATOM 0 HG23 THR A 24 -14.406 5.856 13.284 1.00 0.00 H new ATOM 418 N ASP A 25 -10.015 7.751 12.233 1.00 0.00 N ATOM 419 CA ASP A 25 -9.433 8.935 11.497 1.00 0.00 C ATOM 420 C ASP A 25 -9.331 8.630 9.991 1.00 0.00 C ATOM 421 O ASP A 25 -9.537 9.503 9.168 1.00 0.00 O ATOM 422 CB ASP A 25 -8.030 9.175 12.081 1.00 0.00 C ATOM 423 CG ASP A 25 -7.446 10.463 11.496 1.00 0.00 C ATOM 424 OD1 ASP A 25 -7.423 10.582 10.282 1.00 0.00 O ATOM 425 OD2 ASP A 25 -7.031 11.307 12.272 1.00 0.00 O ATOM 0 H ASP A 25 -9.438 7.379 12.987 1.00 0.00 H new ATOM 0 HA ASP A 25 -10.065 9.815 11.616 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -8.084 9.249 13.167 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -7.380 8.331 11.851 1.00 0.00 H new ATOM 430 N PHE A 26 -9.017 7.402 9.619 1.00 0.00 N ATOM 431 CA PHE A 26 -8.912 7.070 8.148 1.00 0.00 C ATOM 432 C PHE A 26 -10.232 7.395 7.432 1.00 0.00 C ATOM 433 O PHE A 26 -10.230 7.890 6.319 1.00 0.00 O ATOM 434 CB PHE A 26 -8.643 5.561 8.055 1.00 0.00 C ATOM 435 CG PHE A 26 -7.168 5.299 8.203 1.00 0.00 C ATOM 436 CD1 PHE A 26 -6.342 5.297 7.074 1.00 0.00 C ATOM 437 CD2 PHE A 26 -6.627 5.048 9.468 1.00 0.00 C ATOM 438 CE1 PHE A 26 -4.974 5.047 7.211 1.00 0.00 C ATOM 439 CE2 PHE A 26 -5.259 4.798 9.605 1.00 0.00 C ATOM 440 CZ PHE A 26 -4.433 4.798 8.476 1.00 0.00 C ATOM 0 H PHE A 26 -8.832 6.627 10.256 1.00 0.00 H new ATOM 0 HA PHE A 26 -8.119 7.651 7.678 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -9.196 5.035 8.833 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -8.996 5.177 7.098 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -6.761 5.489 6.097 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -7.266 5.047 10.339 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -4.335 5.046 6.340 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -4.840 4.605 10.581 1.00 0.00 H new ATOM 0 HZ PHE A 26 -3.376 4.605 8.582 1.00 0.00 H new ATOM 450 N GLU A 27 -11.358 7.114 8.054 1.00 0.00 N ATOM 451 CA GLU A 27 -12.675 7.406 7.381 1.00 0.00 C ATOM 452 C GLU A 27 -12.825 8.904 7.062 1.00 0.00 C ATOM 453 O GLU A 27 -13.568 9.261 6.171 1.00 0.00 O ATOM 454 CB GLU A 27 -13.780 6.962 8.353 1.00 0.00 C ATOM 455 CG GLU A 27 -13.727 5.442 8.526 1.00 0.00 C ATOM 456 CD GLU A 27 -14.638 4.778 7.491 1.00 0.00 C ATOM 457 OE1 GLU A 27 -15.815 4.629 7.777 1.00 0.00 O ATOM 458 OE2 GLU A 27 -14.144 4.431 6.431 1.00 0.00 O ATOM 0 H GLU A 27 -11.425 6.701 8.984 1.00 0.00 H new ATOM 0 HA GLU A 27 -12.737 6.872 6.433 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -13.650 7.453 9.317 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -14.756 7.262 7.972 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -12.703 5.087 8.406 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -14.043 5.169 9.533 1.00 0.00 H new ATOM 465 N ILE A 28 -12.134 9.787 7.760 1.00 0.00 N ATOM 466 CA ILE A 28 -12.277 11.253 7.439 1.00 0.00 C ATOM 467 C ILE A 28 -11.393 11.609 6.227 1.00 0.00 C ATOM 468 O ILE A 28 -11.772 12.431 5.412 1.00 0.00 O ATOM 469 CB ILE A 28 -11.864 12.028 8.715 1.00 0.00 C ATOM 470 CG1 ILE A 28 -12.985 11.923 9.754 1.00 0.00 C ATOM 471 CG2 ILE A 28 -11.626 13.513 8.402 1.00 0.00 C ATOM 472 CD1 ILE A 28 -12.931 10.560 10.445 1.00 0.00 C ATOM 0 H ILE A 28 -11.492 9.563 8.520 1.00 0.00 H new ATOM 0 HA ILE A 28 -13.299 11.517 7.165 1.00 0.00 H new ATOM 0 HB ILE A 28 -10.941 11.593 9.097 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -12.884 12.719 10.492 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -13.953 12.057 9.272 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -11.337 14.035 9.314 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -10.830 13.606 7.663 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -12.542 13.953 8.006 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -13.731 10.494 11.182 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -13.055 9.771 9.703 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -11.969 10.442 10.943 1.00 0.00 H new ATOM 484 N GLN A 29 -10.240 10.992 6.080 1.00 0.00 N ATOM 485 CA GLN A 29 -9.387 11.308 4.885 1.00 0.00 C ATOM 486 C GLN A 29 -9.883 10.494 3.682 1.00 0.00 C ATOM 487 O GLN A 29 -9.881 10.981 2.565 1.00 0.00 O ATOM 488 CB GLN A 29 -7.947 10.923 5.251 1.00 0.00 C ATOM 489 CG GLN A 29 -6.983 11.502 4.213 1.00 0.00 C ATOM 490 CD GLN A 29 -5.588 11.645 4.833 1.00 0.00 C ATOM 491 OE1 GLN A 29 -5.079 10.714 5.425 1.00 0.00 O ATOM 492 NE2 GLN A 29 -4.938 12.780 4.727 1.00 0.00 N ATOM 0 H GLN A 29 -9.859 10.297 6.722 1.00 0.00 H new ATOM 0 HA GLN A 29 -9.437 12.364 4.618 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -7.699 11.301 6.243 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -7.848 9.838 5.289 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -6.939 10.852 3.339 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -7.341 12.473 3.870 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -5.360 13.565 4.231 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -4.011 12.877 5.140 1.00 0.00 H new ATOM 501 N LEU A 30 -10.329 9.268 3.892 1.00 0.00 N ATOM 502 CA LEU A 30 -10.843 8.464 2.731 1.00 0.00 C ATOM 503 C LEU A 30 -12.225 8.985 2.299 1.00 0.00 C ATOM 504 O LEU A 30 -12.558 8.931 1.129 1.00 0.00 O ATOM 505 CB LEU A 30 -10.940 7.002 3.202 1.00 0.00 C ATOM 506 CG LEU A 30 -10.436 6.076 2.091 1.00 0.00 C ATOM 507 CD1 LEU A 30 -9.676 4.900 2.709 1.00 0.00 C ATOM 508 CD2 LEU A 30 -11.626 5.549 1.284 1.00 0.00 C ATOM 0 H LEU A 30 -10.358 8.800 4.798 1.00 0.00 H new ATOM 0 HA LEU A 30 -10.177 8.546 1.872 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -10.348 6.859 4.106 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -11.972 6.757 3.455 1.00 0.00 H new ATOM 0 HG LEU A 30 -9.769 6.632 1.432 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -9.318 4.242 1.917 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -8.827 5.275 3.280 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -10.341 4.344 3.370 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -11.266 4.890 0.494 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -12.295 4.995 1.942 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -12.165 6.387 0.841 1.00 0.00 H new ATOM 520 N ARG A 31 -13.037 9.501 3.214 1.00 0.00 N ATOM 521 CA ARG A 31 -14.383 10.021 2.781 1.00 0.00 C ATOM 522 C ARG A 31 -14.206 11.299 1.942 1.00 0.00 C ATOM 523 O ARG A 31 -14.929 11.511 0.985 1.00 0.00 O ATOM 524 CB ARG A 31 -15.211 10.298 4.058 1.00 0.00 C ATOM 525 CG ARG A 31 -14.627 11.479 4.846 1.00 0.00 C ATOM 526 CD ARG A 31 -15.504 11.759 6.068 1.00 0.00 C ATOM 527 NE ARG A 31 -16.738 12.399 5.520 1.00 0.00 N ATOM 528 CZ ARG A 31 -16.723 13.643 5.066 1.00 0.00 C ATOM 529 NH1 ARG A 31 -15.625 14.365 5.081 1.00 0.00 N ATOM 530 NH2 ARG A 31 -17.822 14.171 4.592 1.00 0.00 N ATOM 0 H ARG A 31 -12.830 9.581 4.210 1.00 0.00 H new ATOM 0 HA ARG A 31 -14.902 9.292 2.158 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -16.244 10.513 3.786 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -15.225 9.408 4.687 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -13.608 11.252 5.160 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -14.575 12.364 4.211 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -15.741 10.839 6.603 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -14.998 12.417 6.774 1.00 0.00 H new ATOM 0 HE ARG A 31 -17.608 11.868 5.495 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -14.759 13.969 5.448 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -15.638 15.321 4.726 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -18.683 13.625 4.574 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -17.817 15.129 4.241 1.00 0.00 H new ATOM 544 N ASP A 32 -13.247 12.148 2.274 1.00 0.00 N ATOM 545 CA ASP A 32 -13.054 13.394 1.450 1.00 0.00 C ATOM 546 C ASP A 32 -12.634 12.998 0.029 1.00 0.00 C ATOM 547 O ASP A 32 -13.120 13.552 -0.939 1.00 0.00 O ATOM 548 CB ASP A 32 -11.948 14.217 2.128 1.00 0.00 C ATOM 549 CG ASP A 32 -12.567 15.135 3.182 1.00 0.00 C ATOM 550 OD1 ASP A 32 -13.649 15.644 2.935 1.00 0.00 O ATOM 551 OD2 ASP A 32 -11.949 15.317 4.219 1.00 0.00 O ATOM 0 H ASP A 32 -12.606 12.035 3.060 1.00 0.00 H new ATOM 0 HA ASP A 32 -13.972 13.977 1.384 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -11.219 13.553 2.592 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -11.413 14.808 1.385 1.00 0.00 H new ATOM 556 N ALA A 33 -11.749 12.029 -0.109 1.00 0.00 N ATOM 557 CA ALA A 33 -11.331 11.598 -1.489 1.00 0.00 C ATOM 558 C ALA A 33 -12.515 10.910 -2.180 1.00 0.00 C ATOM 559 O ALA A 33 -12.774 11.138 -3.347 1.00 0.00 O ATOM 560 CB ALA A 33 -10.173 10.606 -1.313 1.00 0.00 C ATOM 0 H ALA A 33 -11.306 11.527 0.660 1.00 0.00 H new ATOM 0 HA ALA A 33 -11.021 12.447 -2.099 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -9.835 10.264 -2.291 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -9.349 11.097 -0.795 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -10.512 9.751 -0.727 1.00 0.00 H new ATOM 566 N GLN A 34 -13.247 10.073 -1.467 1.00 0.00 N ATOM 567 CA GLN A 34 -14.425 9.383 -2.104 1.00 0.00 C ATOM 568 C GLN A 34 -15.437 10.423 -2.617 1.00 0.00 C ATOM 569 O GLN A 34 -16.065 10.219 -3.640 1.00 0.00 O ATOM 570 CB GLN A 34 -15.072 8.511 -1.016 1.00 0.00 C ATOM 571 CG GLN A 34 -14.262 7.223 -0.843 1.00 0.00 C ATOM 572 CD GLN A 34 -14.880 6.110 -1.698 1.00 0.00 C ATOM 573 OE1 GLN A 34 -15.433 6.376 -2.747 1.00 0.00 O ATOM 574 NE2 GLN A 34 -14.811 4.864 -1.299 1.00 0.00 N ATOM 0 H GLN A 34 -13.083 9.841 -0.487 1.00 0.00 H new ATOM 0 HA GLN A 34 -14.109 8.779 -2.954 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -15.112 9.057 -0.074 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -16.100 8.273 -1.290 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -13.226 7.390 -1.138 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -14.251 6.926 0.206 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -14.348 4.635 -0.419 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -15.220 4.123 -1.868 1.00 0.00 H new ATOM 583 N LYS A 35 -15.604 11.538 -1.926 1.00 0.00 N ATOM 584 CA LYS A 35 -16.586 12.571 -2.412 1.00 0.00 C ATOM 585 C LYS A 35 -15.935 13.456 -3.486 1.00 0.00 C ATOM 586 O LYS A 35 -16.565 13.804 -4.468 1.00 0.00 O ATOM 587 CB LYS A 35 -16.978 13.414 -1.190 1.00 0.00 C ATOM 588 CG LYS A 35 -17.662 12.522 -0.152 1.00 0.00 C ATOM 589 CD LYS A 35 -19.157 12.430 -0.464 1.00 0.00 C ATOM 590 CE LYS A 35 -19.421 11.201 -1.337 1.00 0.00 C ATOM 591 NZ LYS A 35 -20.784 10.740 -0.950 1.00 0.00 N ATOM 0 H LYS A 35 -15.112 11.772 -1.064 1.00 0.00 H new ATOM 0 HA LYS A 35 -17.462 12.102 -2.860 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -16.093 13.880 -0.757 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -17.648 14.220 -1.491 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -17.216 11.527 -0.161 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -17.513 12.929 0.848 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -19.729 12.362 0.461 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -19.488 13.332 -0.978 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -19.375 11.452 -2.397 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -18.677 10.424 -1.161 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -21.037 9.899 -1.507 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -20.795 10.502 0.062 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -21.472 11.497 -1.135 1.00 0.00 H new ATOM 605 N ASP A 36 -14.680 13.819 -3.316 1.00 0.00 N ATOM 606 CA ASP A 36 -14.006 14.682 -4.354 1.00 0.00 C ATOM 607 C ASP A 36 -14.001 13.962 -5.712 1.00 0.00 C ATOM 608 O ASP A 36 -14.208 14.579 -6.741 1.00 0.00 O ATOM 609 CB ASP A 36 -12.565 14.912 -3.872 1.00 0.00 C ATOM 610 CG ASP A 36 -11.870 15.911 -4.799 1.00 0.00 C ATOM 611 OD1 ASP A 36 -11.854 15.667 -5.995 1.00 0.00 O ATOM 612 OD2 ASP A 36 -11.365 16.902 -4.299 1.00 0.00 O ATOM 0 H ASP A 36 -14.099 13.561 -2.518 1.00 0.00 H new ATOM 0 HA ASP A 36 -14.531 15.629 -4.480 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -12.568 15.290 -2.850 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -12.019 13.969 -3.861 1.00 0.00 H new ATOM 744 N SER A 45 -7.785 15.448 -9.305 1.00 0.00 N ATOM 745 CA SER A 45 -8.708 14.314 -8.985 1.00 0.00 C ATOM 746 C SER A 45 -7.921 13.006 -8.838 1.00 0.00 C ATOM 747 O SER A 45 -8.021 12.331 -7.830 1.00 0.00 O ATOM 748 CB SER A 45 -9.673 14.233 -10.168 1.00 0.00 C ATOM 749 OG SER A 45 -10.636 15.274 -10.062 1.00 0.00 O ATOM 0 HA SER A 45 -9.234 14.471 -8.043 1.00 0.00 H new ATOM 0 HB2 SER A 45 -9.125 14.323 -11.106 1.00 0.00 H new ATOM 0 HB3 SER A 45 -10.170 13.263 -10.181 1.00 0.00 H new ATOM 0 HG SER A 45 -11.255 15.225 -10.820 1.00 0.00 H new ATOM 755 N ASN A 46 -7.134 12.639 -9.828 1.00 0.00 N ATOM 756 CA ASN A 46 -6.340 11.358 -9.720 1.00 0.00 C ATOM 757 C ASN A 46 -5.464 11.385 -8.455 1.00 0.00 C ATOM 758 O ASN A 46 -5.309 10.379 -7.787 1.00 0.00 O ATOM 759 CB ASN A 46 -5.453 11.280 -10.973 1.00 0.00 C ATOM 760 CG ASN A 46 -6.306 10.870 -12.180 1.00 0.00 C ATOM 761 OD1 ASN A 46 -6.782 11.715 -12.911 1.00 0.00 O ATOM 762 ND2 ASN A 46 -6.525 9.600 -12.426 1.00 0.00 N ATOM 0 H ASN A 46 -7.005 13.160 -10.696 1.00 0.00 H new ATOM 0 HA ASN A 46 -6.999 10.493 -9.651 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -4.982 12.245 -11.158 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -4.651 10.558 -10.819 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -7.093 9.326 -13.228 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -6.128 8.886 -11.815 1.00 0.00 H new ATOM 769 N GLU A 47 -4.893 12.526 -8.116 1.00 0.00 N ATOM 770 CA GLU A 47 -4.033 12.588 -6.880 1.00 0.00 C ATOM 771 C GLU A 47 -4.878 12.257 -5.641 1.00 0.00 C ATOM 772 O GLU A 47 -4.427 11.555 -4.755 1.00 0.00 O ATOM 773 CB GLU A 47 -3.492 14.024 -6.784 1.00 0.00 C ATOM 774 CG GLU A 47 -2.609 14.319 -7.997 1.00 0.00 C ATOM 775 CD GLU A 47 -1.684 15.495 -7.680 1.00 0.00 C ATOM 776 OE1 GLU A 47 -0.705 15.284 -6.984 1.00 0.00 O ATOM 777 OE2 GLU A 47 -1.971 16.589 -8.139 1.00 0.00 O ATOM 0 H GLU A 47 -4.983 13.402 -8.631 1.00 0.00 H new ATOM 0 HA GLU A 47 -3.216 11.868 -6.932 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -4.319 14.733 -6.742 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -2.919 14.147 -5.865 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -2.020 13.439 -8.254 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -3.228 14.553 -8.863 1.00 0.00 H new ATOM 784 N GLN A 48 -6.100 12.752 -5.566 1.00 0.00 N ATOM 785 CA GLN A 48 -6.952 12.439 -4.363 1.00 0.00 C ATOM 786 C GLN A 48 -7.201 10.926 -4.282 1.00 0.00 C ATOM 787 O GLN A 48 -7.171 10.349 -3.210 1.00 0.00 O ATOM 788 CB GLN A 48 -8.283 13.184 -4.549 1.00 0.00 C ATOM 789 CG GLN A 48 -8.973 13.348 -3.192 1.00 0.00 C ATOM 790 CD GLN A 48 -8.121 14.243 -2.284 1.00 0.00 C ATOM 791 OE1 GLN A 48 -7.826 15.370 -2.631 1.00 0.00 O ATOM 792 NE2 GLN A 48 -7.708 13.792 -1.124 1.00 0.00 N ATOM 0 H GLN A 48 -6.536 13.347 -6.270 1.00 0.00 H new ATOM 0 HA GLN A 48 -6.460 12.750 -3.442 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -8.105 14.161 -4.998 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -8.928 12.632 -5.232 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -9.962 13.786 -3.327 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -9.117 12.373 -2.726 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -7.953 12.847 -0.828 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -7.142 14.386 -0.518 1.00 0.00 H new ATOM 801 N LEU A 49 -7.445 10.272 -5.403 1.00 0.00 N ATOM 802 CA LEU A 49 -7.691 8.785 -5.360 1.00 0.00 C ATOM 803 C LEU A 49 -6.474 8.066 -4.759 1.00 0.00 C ATOM 804 O LEU A 49 -6.624 7.126 -4.000 1.00 0.00 O ATOM 805 CB LEU A 49 -7.915 8.326 -6.810 1.00 0.00 C ATOM 806 CG LEU A 49 -9.403 8.412 -7.148 1.00 0.00 C ATOM 807 CD1 LEU A 49 -9.610 8.092 -8.629 1.00 0.00 C ATOM 808 CD2 LEU A 49 -10.177 7.403 -6.296 1.00 0.00 C ATOM 0 H LEU A 49 -7.484 10.695 -6.330 1.00 0.00 H new ATOM 0 HA LEU A 49 -8.556 8.550 -4.740 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -7.339 8.950 -7.493 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -7.561 7.303 -6.938 1.00 0.00 H new ATOM 0 HG LEU A 49 -9.765 9.419 -6.940 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -10.671 8.153 -8.870 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -9.058 8.809 -9.237 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -9.248 7.085 -8.838 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -11.239 7.463 -6.536 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -9.814 6.397 -6.505 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -10.030 7.630 -5.240 1.00 0.00 H new ATOM 820 N TRP A 50 -5.268 8.495 -5.084 1.00 0.00 N ATOM 821 CA TRP A 50 -4.059 7.807 -4.504 1.00 0.00 C ATOM 822 C TRP A 50 -4.068 7.923 -2.976 1.00 0.00 C ATOM 823 O TRP A 50 -3.686 6.997 -2.288 1.00 0.00 O ATOM 824 CB TRP A 50 -2.815 8.493 -5.104 1.00 0.00 C ATOM 825 CG TRP A 50 -2.818 8.372 -6.608 1.00 0.00 C ATOM 826 CD1 TRP A 50 -3.547 7.482 -7.339 1.00 0.00 C ATOM 827 CD2 TRP A 50 -2.055 9.153 -7.576 1.00 0.00 C ATOM 828 NE1 TRP A 50 -3.288 7.687 -8.681 1.00 0.00 N ATOM 829 CE2 TRP A 50 -2.377 8.701 -8.876 1.00 0.00 C ATOM 830 CE3 TRP A 50 -1.128 10.204 -7.452 1.00 0.00 C ATOM 831 CZ2 TRP A 50 -1.804 9.269 -10.009 1.00 0.00 C ATOM 832 CZ3 TRP A 50 -0.544 10.774 -8.596 1.00 0.00 C ATOM 833 CH2 TRP A 50 -0.885 10.306 -9.873 1.00 0.00 C ATOM 0 H TRP A 50 -5.071 9.274 -5.712 1.00 0.00 H new ATOM 0 HA TRP A 50 -4.057 6.744 -4.747 1.00 0.00 H new ATOM 0 HB2 TRP A 50 -2.799 9.545 -4.818 1.00 0.00 H new ATOM 0 HB3 TRP A 50 -1.911 8.039 -4.699 1.00 0.00 H new ATOM 0 HD1 TRP A 50 -4.218 6.738 -6.935 1.00 0.00 H new ATOM 0 HE1 TRP A 50 -3.719 7.152 -9.435 1.00 0.00 H new ATOM 0 HE3 TRP A 50 -0.864 10.575 -6.473 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 -2.071 8.907 -10.991 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 0.171 11.577 -8.491 1.00 0.00 H new ATOM 0 HH2 TRP A 50 -0.436 10.749 -10.749 1.00 0.00 H new ATOM 844 N GLU A 51 -4.519 9.036 -2.428 1.00 0.00 N ATOM 845 CA GLU A 51 -4.558 9.155 -0.926 1.00 0.00 C ATOM 846 C GLU A 51 -5.438 8.040 -0.329 1.00 0.00 C ATOM 847 O GLU A 51 -5.181 7.573 0.765 1.00 0.00 O ATOM 848 CB GLU A 51 -5.154 10.534 -0.600 1.00 0.00 C ATOM 849 CG GLU A 51 -4.610 11.022 0.743 1.00 0.00 C ATOM 850 CD GLU A 51 -3.230 11.650 0.537 1.00 0.00 C ATOM 851 OE1 GLU A 51 -2.477 11.126 -0.267 1.00 0.00 O ATOM 852 OE2 GLU A 51 -2.950 12.644 1.187 1.00 0.00 O ATOM 0 H GLU A 51 -4.855 9.850 -2.943 1.00 0.00 H new ATOM 0 HA GLU A 51 -3.559 9.054 -0.501 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -4.902 11.246 -1.386 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -6.242 10.472 -0.563 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -5.292 11.752 1.180 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -4.542 10.190 1.444 1.00 0.00 H new ATOM 859 N ILE A 52 -6.464 7.591 -1.037 1.00 0.00 N ATOM 860 CA ILE A 52 -7.322 6.489 -0.477 1.00 0.00 C ATOM 861 C ILE A 52 -6.530 5.176 -0.518 1.00 0.00 C ATOM 862 O ILE A 52 -6.269 4.583 0.513 1.00 0.00 O ATOM 863 CB ILE A 52 -8.582 6.411 -1.358 1.00 0.00 C ATOM 864 CG1 ILE A 52 -9.339 7.739 -1.254 1.00 0.00 C ATOM 865 CG2 ILE A 52 -9.484 5.270 -0.873 1.00 0.00 C ATOM 866 CD1 ILE A 52 -10.562 7.728 -2.176 1.00 0.00 C ATOM 0 H ILE A 52 -6.736 7.934 -1.958 1.00 0.00 H new ATOM 0 HA ILE A 52 -7.608 6.675 0.558 1.00 0.00 H new ATOM 0 HB ILE A 52 -8.296 6.224 -2.393 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -9.653 7.906 -0.224 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -8.679 8.564 -1.524 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -10.374 5.219 -1.500 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -8.942 4.326 -0.935 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -9.778 5.453 0.161 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -11.090 8.678 -2.091 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -10.239 7.583 -3.207 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -11.228 6.915 -1.887 1.00 0.00 H new ATOM 878 N MET A 53 -6.116 4.724 -1.690 1.00 0.00 N ATOM 879 CA MET A 53 -5.309 3.451 -1.733 1.00 0.00 C ATOM 880 C MET A 53 -3.999 3.640 -0.944 1.00 0.00 C ATOM 881 O MET A 53 -3.486 2.695 -0.374 1.00 0.00 O ATOM 882 CB MET A 53 -5.026 3.112 -3.212 1.00 0.00 C ATOM 883 CG MET A 53 -4.227 4.231 -3.891 1.00 0.00 C ATOM 884 SD MET A 53 -4.766 4.386 -5.617 1.00 0.00 S ATOM 885 CE MET A 53 -4.164 2.781 -6.192 1.00 0.00 C ATOM 0 H MET A 53 -6.295 5.166 -2.591 1.00 0.00 H new ATOM 0 HA MET A 53 -5.857 2.629 -1.273 1.00 0.00 H new ATOM 0 HB2 MET A 53 -4.472 2.176 -3.274 1.00 0.00 H new ATOM 0 HB3 MET A 53 -5.967 2.961 -3.740 1.00 0.00 H new ATOM 0 HG2 MET A 53 -4.378 5.173 -3.364 1.00 0.00 H new ATOM 0 HG3 MET A 53 -3.161 4.010 -3.849 1.00 0.00 H new ATOM 0 HE1 MET A 53 -3.653 2.905 -7.147 1.00 0.00 H new ATOM 0 HE2 MET A 53 -3.470 2.369 -5.460 1.00 0.00 H new ATOM 0 HE3 MET A 53 -5.006 2.100 -6.317 1.00 0.00 H new ATOM 895 N GLN A 54 -3.462 4.850 -0.872 1.00 0.00 N ATOM 896 CA GLN A 54 -2.203 5.054 -0.072 1.00 0.00 C ATOM 897 C GLN A 54 -2.532 4.915 1.423 1.00 0.00 C ATOM 898 O GLN A 54 -1.763 4.349 2.176 1.00 0.00 O ATOM 899 CB GLN A 54 -1.699 6.473 -0.382 1.00 0.00 C ATOM 900 CG GLN A 54 -1.039 6.489 -1.762 1.00 0.00 C ATOM 901 CD GLN A 54 0.471 6.263 -1.610 1.00 0.00 C ATOM 902 OE1 GLN A 54 0.889 5.363 -0.908 1.00 0.00 O ATOM 903 NE2 GLN A 54 1.316 7.043 -2.239 1.00 0.00 N ATOM 0 H GLN A 54 -3.835 5.685 -1.324 1.00 0.00 H new ATOM 0 HA GLN A 54 -1.440 4.318 -0.325 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -2.529 7.179 -0.356 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -0.985 6.791 0.378 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -1.472 5.713 -2.393 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -1.227 7.442 -2.256 1.00 0.00 H new ATOM 0 HE21 GLN A 54 0.970 7.799 -2.829 1.00 0.00 H new ATOM 0 HE22 GLN A 54 2.320 6.894 -2.138 1.00 0.00 H new ATOM 912 N LEU A 55 -3.682 5.408 1.863 1.00 0.00 N ATOM 913 CA LEU A 55 -4.050 5.269 3.322 1.00 0.00 C ATOM 914 C LEU A 55 -3.966 3.791 3.750 1.00 0.00 C ATOM 915 O LEU A 55 -3.619 3.490 4.877 1.00 0.00 O ATOM 916 CB LEU A 55 -5.499 5.766 3.470 1.00 0.00 C ATOM 917 CG LEU A 55 -5.513 7.269 3.770 1.00 0.00 C ATOM 918 CD1 LEU A 55 -6.943 7.802 3.629 1.00 0.00 C ATOM 919 CD2 LEU A 55 -5.018 7.514 5.200 1.00 0.00 C ATOM 0 H LEU A 55 -4.369 5.892 1.285 1.00 0.00 H new ATOM 0 HA LEU A 55 -3.369 5.845 3.948 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -6.056 5.565 2.555 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -5.998 5.223 4.272 1.00 0.00 H new ATOM 0 HG LEU A 55 -4.858 7.784 3.067 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -6.956 8.871 3.842 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -7.297 7.630 2.612 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -7.595 7.284 4.332 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -5.029 8.583 5.411 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -5.671 6.999 5.904 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -4.001 7.134 5.303 1.00 0.00 H new ATOM 931 N HIS A 56 -4.275 2.859 2.860 1.00 0.00 N ATOM 932 CA HIS A 56 -4.200 1.400 3.243 1.00 0.00 C ATOM 933 C HIS A 56 -2.801 1.073 3.792 1.00 0.00 C ATOM 934 O HIS A 56 -2.669 0.321 4.741 1.00 0.00 O ATOM 935 CB HIS A 56 -4.467 0.589 1.964 1.00 0.00 C ATOM 936 CG HIS A 56 -4.503 -0.875 2.299 1.00 0.00 C ATOM 937 ND1 HIS A 56 -5.687 -1.546 2.562 1.00 0.00 N ATOM 938 CD2 HIS A 56 -3.506 -1.809 2.422 1.00 0.00 C ATOM 939 CE1 HIS A 56 -5.375 -2.827 2.830 1.00 0.00 C ATOM 940 NE2 HIS A 56 -4.059 -3.041 2.758 1.00 0.00 N ATOM 0 H HIS A 56 -4.571 3.043 1.901 1.00 0.00 H new ATOM 0 HA HIS A 56 -4.929 1.160 4.017 1.00 0.00 H new ATOM 0 HB2 HIS A 56 -5.413 0.894 1.518 1.00 0.00 H new ATOM 0 HB3 HIS A 56 -3.689 0.785 1.227 1.00 0.00 H new ATOM 0 HD1 HIS A 56 -6.624 -1.142 2.554 1.00 0.00 H new ATOM 0 HD2 HIS A 56 -2.453 -1.617 2.280 1.00 0.00 H new ATOM 0 HE1 HIS A 56 -6.100 -3.589 3.074 1.00 0.00 H new ATOM 948 N HIS A 57 -1.753 1.637 3.215 1.00 0.00 N ATOM 949 CA HIS A 57 -0.370 1.345 3.743 1.00 0.00 C ATOM 950 C HIS A 57 -0.289 1.768 5.214 1.00 0.00 C ATOM 951 O HIS A 57 0.192 1.024 6.049 1.00 0.00 O ATOM 952 CB HIS A 57 0.616 2.172 2.904 1.00 0.00 C ATOM 953 CG HIS A 57 1.061 1.367 1.718 1.00 0.00 C ATOM 954 ND1 HIS A 57 2.260 1.613 1.067 1.00 0.00 N ATOM 955 CD2 HIS A 57 0.482 0.314 1.055 1.00 0.00 C ATOM 956 CE1 HIS A 57 2.363 0.725 0.061 1.00 0.00 C ATOM 957 NE2 HIS A 57 1.306 -0.091 0.010 1.00 0.00 N ATOM 0 H HIS A 57 -1.793 2.273 2.419 1.00 0.00 H new ATOM 0 HA HIS A 57 -0.136 0.283 3.676 1.00 0.00 H new ATOM 0 HB2 HIS A 57 0.142 3.096 2.573 1.00 0.00 H new ATOM 0 HB3 HIS A 57 1.477 2.454 3.509 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -0.469 -0.132 1.306 1.00 0.00 H new ATOM 0 HE1 HIS A 57 3.198 0.678 -0.622 1.00 0.00 H new ATOM 0 HE2 HIS A 57 1.139 -0.848 -0.653 1.00 0.00 H new ATOM 965 N GLN A 58 -0.774 2.948 5.544 1.00 0.00 N ATOM 966 CA GLN A 58 -0.734 3.387 6.982 1.00 0.00 C ATOM 967 C GLN A 58 -1.568 2.413 7.834 1.00 0.00 C ATOM 968 O GLN A 58 -1.195 2.092 8.947 1.00 0.00 O ATOM 969 CB GLN A 58 -1.333 4.802 7.031 1.00 0.00 C ATOM 970 CG GLN A 58 -1.042 5.434 8.395 1.00 0.00 C ATOM 971 CD GLN A 58 0.305 6.167 8.342 1.00 0.00 C ATOM 972 OE1 GLN A 58 1.333 5.578 8.609 1.00 0.00 O ATOM 973 NE2 GLN A 58 0.347 7.434 8.009 1.00 0.00 N ATOM 0 H GLN A 58 -1.188 3.615 4.893 1.00 0.00 H new ATOM 0 HA GLN A 58 0.283 3.391 7.375 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -0.909 5.416 6.236 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -2.409 4.759 6.861 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -1.837 6.130 8.662 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -1.019 4.665 9.167 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -0.515 7.931 7.784 1.00 0.00 H new ATOM 0 HE22 GLN A 58 1.242 7.923 7.975 1.00 0.00 H new ATOM 982 N ARG A 59 -2.685 1.922 7.318 1.00 0.00 N ATOM 983 CA ARG A 59 -3.506 0.950 8.123 1.00 0.00 C ATOM 984 C ARG A 59 -2.694 -0.334 8.346 1.00 0.00 C ATOM 985 O ARG A 59 -2.564 -0.798 9.464 1.00 0.00 O ATOM 986 CB ARG A 59 -4.772 0.633 7.305 1.00 0.00 C ATOM 987 CG ARG A 59 -5.880 1.633 7.650 1.00 0.00 C ATOM 988 CD ARG A 59 -6.333 1.433 9.101 1.00 0.00 C ATOM 989 NE ARG A 59 -7.599 0.639 9.016 1.00 0.00 N ATOM 990 CZ ARG A 59 -8.718 1.167 8.541 1.00 0.00 C ATOM 991 NH1 ARG A 59 -8.753 2.396 8.087 1.00 0.00 N ATOM 992 NH2 ARG A 59 -9.813 0.453 8.518 1.00 0.00 N ATOM 0 H ARG A 59 -3.054 2.149 6.394 1.00 0.00 H new ATOM 0 HA ARG A 59 -3.772 1.368 9.094 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -4.548 0.679 6.239 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -5.108 -0.382 7.517 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -5.518 2.652 7.510 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -6.725 1.499 6.975 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -5.576 0.904 9.680 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -6.502 2.390 9.595 1.00 0.00 H new ATOM 0 HE ARG A 59 -7.601 -0.331 9.331 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -7.908 2.967 8.095 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -9.626 2.782 7.726 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -9.804 -0.506 8.865 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -10.677 0.855 8.153 1.00 0.00 H new ATOM 1006 N SER A 60 -2.134 -0.911 7.295 1.00 0.00 N ATOM 1007 CA SER A 60 -1.323 -2.162 7.484 1.00 0.00 C ATOM 1008 C SER A 60 -0.114 -1.849 8.369 1.00 0.00 C ATOM 1009 O SER A 60 0.234 -2.629 9.225 1.00 0.00 O ATOM 1010 CB SER A 60 -0.863 -2.618 6.091 1.00 0.00 C ATOM 1011 OG SER A 60 -0.033 -1.616 5.519 1.00 0.00 O ATOM 0 H SER A 60 -2.204 -0.574 6.335 1.00 0.00 H new ATOM 0 HA SER A 60 -1.906 -2.947 7.966 1.00 0.00 H new ATOM 0 HB2 SER A 60 -0.318 -3.559 6.165 1.00 0.00 H new ATOM 0 HB3 SER A 60 -1.727 -2.800 5.452 1.00 0.00 H new ATOM 0 HG SER A 60 -0.289 -0.738 5.872 1.00 0.00 H new ATOM 1017 N ARG A 61 0.522 -0.708 8.187 1.00 0.00 N ATOM 1018 CA ARG A 61 1.700 -0.373 9.064 1.00 0.00 C ATOM 1019 C ARG A 61 1.225 -0.212 10.518 1.00 0.00 C ATOM 1020 O ARG A 61 1.903 -0.621 11.441 1.00 0.00 O ATOM 1021 CB ARG A 61 2.284 0.950 8.543 1.00 0.00 C ATOM 1022 CG ARG A 61 3.621 1.226 9.234 1.00 0.00 C ATOM 1023 CD ARG A 61 4.546 1.978 8.274 1.00 0.00 C ATOM 1024 NE ARG A 61 5.255 0.910 7.505 1.00 0.00 N ATOM 1025 CZ ARG A 61 6.222 0.193 8.056 1.00 0.00 C ATOM 1026 NH1 ARG A 61 6.598 0.389 9.299 1.00 0.00 N ATOM 1027 NH2 ARG A 61 6.819 -0.734 7.353 1.00 0.00 N ATOM 0 H ARG A 61 0.283 -0.008 7.485 1.00 0.00 H new ATOM 0 HA ARG A 61 2.453 -1.160 9.038 1.00 0.00 H new ATOM 0 HB2 ARG A 61 2.425 0.897 7.463 1.00 0.00 H new ATOM 0 HB3 ARG A 61 1.588 1.767 8.734 1.00 0.00 H new ATOM 0 HG2 ARG A 61 3.461 1.814 10.137 1.00 0.00 H new ATOM 0 HG3 ARG A 61 4.084 0.288 9.542 1.00 0.00 H new ATOM 0 HD2 ARG A 61 3.980 2.632 7.611 1.00 0.00 H new ATOM 0 HD3 ARG A 61 5.251 2.608 8.817 1.00 0.00 H new ATOM 0 HE ARG A 61 4.989 0.730 6.537 1.00 0.00 H new ATOM 0 HH11 ARG A 61 6.142 1.107 9.863 1.00 0.00 H new ATOM 0 HH12 ARG A 61 7.346 -0.177 9.701 1.00 0.00 H new ATOM 0 HH21 ARG A 61 6.539 -0.901 6.387 1.00 0.00 H new ATOM 0 HH22 ARG A 61 7.565 -1.290 7.771 1.00 0.00 H new ATOM 1041 N TYR A 62 0.060 0.374 10.734 1.00 0.00 N ATOM 1042 CA TYR A 62 -0.443 0.540 12.146 1.00 0.00 C ATOM 1043 C TYR A 62 -0.606 -0.842 12.801 1.00 0.00 C ATOM 1044 O TYR A 62 -0.129 -1.069 13.900 1.00 0.00 O ATOM 1045 CB TYR A 62 -1.804 1.249 12.045 1.00 0.00 C ATOM 1046 CG TYR A 62 -2.357 1.496 13.427 1.00 0.00 C ATOM 1047 CD1 TYR A 62 -3.019 0.468 14.106 1.00 0.00 C ATOM 1048 CD2 TYR A 62 -2.210 2.752 14.026 1.00 0.00 C ATOM 1049 CE1 TYR A 62 -3.535 0.696 15.387 1.00 0.00 C ATOM 1050 CE2 TYR A 62 -2.726 2.981 15.306 1.00 0.00 C ATOM 1051 CZ TYR A 62 -3.389 1.953 15.988 1.00 0.00 C ATOM 1052 OH TYR A 62 -3.899 2.179 17.250 1.00 0.00 O ATOM 0 H TYR A 62 -0.554 0.739 10.006 1.00 0.00 H new ATOM 0 HA TYR A 62 0.252 1.119 12.755 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -1.693 2.194 11.514 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -2.500 0.639 11.469 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -3.132 -0.501 13.642 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -1.698 3.545 13.500 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -4.046 -0.097 15.912 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -2.613 3.951 15.768 1.00 0.00 H new ATOM 0 HH TYR A 62 -3.710 3.102 17.519 1.00 0.00 H new ATOM 1062 N ILE A 63 -1.253 -1.776 12.130 1.00 0.00 N ATOM 1063 CA ILE A 63 -1.413 -3.146 12.734 1.00 0.00 C ATOM 1064 C ILE A 63 -0.081 -3.905 12.606 1.00 0.00 C ATOM 1065 O ILE A 63 0.358 -4.556 13.534 1.00 0.00 O ATOM 1066 CB ILE A 63 -2.524 -3.852 11.940 1.00 0.00 C ATOM 1067 CG1 ILE A 63 -3.827 -3.057 12.076 1.00 0.00 C ATOM 1068 CG2 ILE A 63 -2.732 -5.263 12.491 1.00 0.00 C ATOM 1069 CD1 ILE A 63 -4.904 -3.676 11.181 1.00 0.00 C ATOM 0 H ILE A 63 -1.670 -1.652 11.207 1.00 0.00 H new ATOM 0 HA ILE A 63 -1.676 -3.101 13.791 1.00 0.00 H new ATOM 0 HB ILE A 63 -2.237 -3.912 10.890 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -4.158 -3.058 13.114 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -3.661 -2.017 11.796 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -3.520 -5.762 11.927 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -1.806 -5.830 12.399 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -3.019 -5.205 13.541 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -5.829 -3.109 11.280 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -4.573 -3.652 10.143 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -5.078 -4.709 11.482 1.00 0.00 H new ATOM 1081 N TYR A 64 0.575 -3.803 11.468 1.00 0.00 N ATOM 1082 CA TYR A 64 1.898 -4.503 11.295 1.00 0.00 C ATOM 1083 C TYR A 64 2.924 -3.975 12.312 1.00 0.00 C ATOM 1084 O TYR A 64 3.882 -4.654 12.619 1.00 0.00 O ATOM 1085 CB TYR A 64 2.372 -4.191 9.866 1.00 0.00 C ATOM 1086 CG TYR A 64 3.588 -5.018 9.536 1.00 0.00 C ATOM 1087 CD1 TYR A 64 3.493 -6.412 9.501 1.00 0.00 C ATOM 1088 CD2 TYR A 64 4.808 -4.392 9.253 1.00 0.00 C ATOM 1089 CE1 TYR A 64 4.614 -7.182 9.186 1.00 0.00 C ATOM 1090 CE2 TYR A 64 5.933 -5.164 8.938 1.00 0.00 C ATOM 1091 CZ TYR A 64 5.836 -6.560 8.905 1.00 0.00 C ATOM 1092 OH TYR A 64 6.945 -7.321 8.594 1.00 0.00 O ATOM 0 H TYR A 64 0.256 -3.271 10.658 1.00 0.00 H new ATOM 0 HA TYR A 64 1.795 -5.576 11.458 1.00 0.00 H new ATOM 0 HB2 TYR A 64 1.574 -4.403 9.155 1.00 0.00 H new ATOM 0 HB3 TYR A 64 2.607 -3.131 9.775 1.00 0.00 H new ATOM 0 HD1 TYR A 64 2.551 -6.894 9.718 1.00 0.00 H new ATOM 0 HD2 TYR A 64 4.881 -3.315 9.278 1.00 0.00 H new ATOM 0 HE1 TYR A 64 4.538 -8.259 9.159 1.00 0.00 H new ATOM 0 HE2 TYR A 64 6.875 -4.683 8.721 1.00 0.00 H new ATOM 0 HH TYR A 64 7.709 -6.731 8.425 1.00 0.00 H new ATOM 1102 N THR A 65 2.751 -2.776 12.842 1.00 0.00 N ATOM 1103 CA THR A 65 3.750 -2.263 13.833 1.00 0.00 C ATOM 1104 C THR A 65 3.336 -2.647 15.263 1.00 0.00 C ATOM 1105 O THR A 65 4.181 -2.920 16.093 1.00 0.00 O ATOM 1106 CB THR A 65 3.779 -0.734 13.671 1.00 0.00 C ATOM 1107 OG1 THR A 65 4.105 -0.410 12.327 1.00 0.00 O ATOM 1108 CG2 THR A 65 4.828 -0.133 14.609 1.00 0.00 C ATOM 0 H THR A 65 1.976 -2.147 12.633 1.00 0.00 H new ATOM 0 HA THR A 65 4.735 -2.695 13.658 1.00 0.00 H new ATOM 0 HB THR A 65 2.799 -0.326 13.920 1.00 0.00 H new ATOM 0 HG1 THR A 65 3.289 -0.164 11.843 1.00 0.00 H new ATOM 0 HG21 THR A 65 4.844 0.950 14.490 1.00 0.00 H new ATOM 0 HG22 THR A 65 4.578 -0.381 15.641 1.00 0.00 H new ATOM 0 HG23 THR A 65 5.810 -0.540 14.365 1.00 0.00 H new ATOM 1116 N LEU A 66 2.051 -2.656 15.574 1.00 0.00 N ATOM 1117 CA LEU A 66 1.643 -3.013 16.977 1.00 0.00 C ATOM 1118 C LEU A 66 1.573 -4.543 17.198 1.00 0.00 C ATOM 1119 O LEU A 66 1.832 -5.012 18.290 1.00 0.00 O ATOM 1120 CB LEU A 66 0.274 -2.337 17.236 1.00 0.00 C ATOM 1121 CG LEU A 66 -0.849 -3.021 16.439 1.00 0.00 C ATOM 1122 CD1 LEU A 66 -1.397 -4.213 17.235 1.00 0.00 C ATOM 1123 CD2 LEU A 66 -1.978 -2.012 16.194 1.00 0.00 C ATOM 0 H LEU A 66 1.288 -2.437 14.934 1.00 0.00 H new ATOM 0 HA LEU A 66 2.391 -2.655 17.685 1.00 0.00 H new ATOM 0 HB2 LEU A 66 0.043 -2.376 18.300 1.00 0.00 H new ATOM 0 HB3 LEU A 66 0.329 -1.284 16.960 1.00 0.00 H new ATOM 0 HG LEU A 66 -0.455 -3.375 15.486 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -2.193 -4.695 16.667 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -0.595 -4.929 17.416 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -1.793 -3.863 18.188 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -2.778 -2.491 15.629 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -2.368 -1.663 17.150 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -1.592 -1.164 15.628 1.00 0.00 H new ATOM 1135 N TYR A 67 1.220 -5.325 16.194 1.00 0.00 N ATOM 1136 CA TYR A 67 1.137 -6.819 16.411 1.00 0.00 C ATOM 1137 C TYR A 67 2.507 -7.492 16.201 1.00 0.00 C ATOM 1138 O TYR A 67 2.841 -8.432 16.901 1.00 0.00 O ATOM 1139 CB TYR A 67 0.106 -7.359 15.397 1.00 0.00 C ATOM 1140 CG TYR A 67 -0.002 -8.870 15.522 1.00 0.00 C ATOM 1141 CD1 TYR A 67 0.938 -9.690 14.886 1.00 0.00 C ATOM 1142 CD2 TYR A 67 -1.032 -9.448 16.280 1.00 0.00 C ATOM 1143 CE1 TYR A 67 0.849 -11.082 15.003 1.00 0.00 C ATOM 1144 CE2 TYR A 67 -1.119 -10.843 16.399 1.00 0.00 C ATOM 1145 CZ TYR A 67 -0.179 -11.658 15.760 1.00 0.00 C ATOM 1146 OH TYR A 67 -0.264 -13.031 15.875 1.00 0.00 O ATOM 0 H TYR A 67 0.990 -5.005 15.253 1.00 0.00 H new ATOM 0 HA TYR A 67 0.835 -7.039 17.435 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -0.867 -6.900 15.575 1.00 0.00 H new ATOM 0 HB3 TYR A 67 0.404 -7.090 14.384 1.00 0.00 H new ATOM 0 HD1 TYR A 67 1.733 -9.248 14.304 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -1.758 -8.818 16.772 1.00 0.00 H new ATOM 0 HE1 TYR A 67 1.574 -11.712 14.509 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -1.911 -11.287 16.983 1.00 0.00 H new ATOM 0 HH TYR A 67 -1.033 -13.265 16.435 1.00 0.00 H new ATOM 1156 N TYR A 68 3.292 -7.050 15.239 1.00 0.00 N ATOM 1157 CA TYR A 68 4.621 -7.723 15.007 1.00 0.00 C ATOM 1158 C TYR A 68 5.758 -7.091 15.839 1.00 0.00 C ATOM 1159 O TYR A 68 6.768 -7.732 16.068 1.00 0.00 O ATOM 1160 CB TYR A 68 4.912 -7.590 13.505 1.00 0.00 C ATOM 1161 CG TYR A 68 4.287 -8.748 12.759 1.00 0.00 C ATOM 1162 CD1 TYR A 68 4.730 -10.054 13.002 1.00 0.00 C ATOM 1163 CD2 TYR A 68 3.266 -8.517 11.822 1.00 0.00 C ATOM 1164 CE1 TYR A 68 4.158 -11.128 12.310 1.00 0.00 C ATOM 1165 CE2 TYR A 68 2.695 -9.594 11.132 1.00 0.00 C ATOM 1166 CZ TYR A 68 3.141 -10.898 11.376 1.00 0.00 C ATOM 1167 OH TYR A 68 2.577 -11.959 10.696 1.00 0.00 O ATOM 0 H TYR A 68 3.078 -6.271 14.617 1.00 0.00 H new ATOM 0 HA TYR A 68 4.572 -8.765 15.323 1.00 0.00 H new ATOM 0 HB2 TYR A 68 4.515 -6.647 13.130 1.00 0.00 H new ATOM 0 HB3 TYR A 68 5.988 -7.573 13.334 1.00 0.00 H new ATOM 0 HD1 TYR A 68 5.513 -10.233 13.724 1.00 0.00 H new ATOM 0 HD2 TYR A 68 2.922 -7.511 11.634 1.00 0.00 H new ATOM 0 HE1 TYR A 68 4.502 -12.135 12.497 1.00 0.00 H new ATOM 0 HE2 TYR A 68 1.910 -9.418 10.411 1.00 0.00 H new ATOM 0 HH TYR A 68 1.885 -11.626 10.087 1.00 0.00 H new ATOM 1177 N LYS A 69 5.630 -5.856 16.293 1.00 0.00 N ATOM 1178 CA LYS A 69 6.741 -5.247 17.098 1.00 0.00 C ATOM 1179 C LYS A 69 6.257 -4.856 18.506 1.00 0.00 C ATOM 1180 O LYS A 69 6.771 -5.349 19.494 1.00 0.00 O ATOM 1181 CB LYS A 69 7.181 -3.995 16.331 1.00 0.00 C ATOM 1182 CG LYS A 69 7.602 -4.360 14.905 1.00 0.00 C ATOM 1183 CD LYS A 69 7.260 -3.198 13.967 1.00 0.00 C ATOM 1184 CE LYS A 69 6.753 -3.746 12.630 1.00 0.00 C ATOM 1185 NZ LYS A 69 7.972 -3.880 11.784 1.00 0.00 N ATOM 0 H LYS A 69 4.818 -5.257 16.142 1.00 0.00 H new ATOM 0 HA LYS A 69 7.559 -5.956 17.228 1.00 0.00 H new ATOM 0 HB2 LYS A 69 6.365 -3.273 16.302 1.00 0.00 H new ATOM 0 HB3 LYS A 69 8.011 -3.516 16.850 1.00 0.00 H new ATOM 0 HG2 LYS A 69 8.671 -4.568 14.871 1.00 0.00 H new ATOM 0 HG3 LYS A 69 7.090 -5.267 14.582 1.00 0.00 H new ATOM 0 HD2 LYS A 69 6.500 -2.562 14.422 1.00 0.00 H new ATOM 0 HD3 LYS A 69 8.141 -2.577 13.806 1.00 0.00 H new ATOM 0 HE2 LYS A 69 6.255 -4.707 12.760 1.00 0.00 H new ATOM 0 HE3 LYS A 69 6.029 -3.070 12.175 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 7.707 -4.251 10.849 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 8.421 -2.949 11.672 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 8.640 -4.534 12.239 1.00 0.00 H new ATOM 1199 N ARG A 70 5.285 -3.970 18.614 1.00 0.00 N ATOM 1200 CA ARG A 70 4.800 -3.560 19.984 1.00 0.00 C ATOM 1201 C ARG A 70 4.253 -4.771 20.758 1.00 0.00 C ATOM 1202 O ARG A 70 4.322 -4.806 21.973 1.00 0.00 O ATOM 1203 CB ARG A 70 3.683 -2.526 19.769 1.00 0.00 C ATOM 1204 CG ARG A 70 3.532 -1.670 21.028 1.00 0.00 C ATOM 1205 CD ARG A 70 2.734 -0.407 20.694 1.00 0.00 C ATOM 1206 NE ARG A 70 2.701 0.375 21.968 1.00 0.00 N ATOM 1207 CZ ARG A 70 3.766 1.032 22.400 1.00 0.00 C ATOM 1208 NH1 ARG A 70 4.896 1.023 21.728 1.00 0.00 N ATOM 1209 NH2 ARG A 70 3.700 1.706 23.518 1.00 0.00 N ATOM 0 H ARG A 70 4.813 -3.520 17.830 1.00 0.00 H new ATOM 0 HA ARG A 70 5.620 -3.144 20.570 1.00 0.00 H new ATOM 0 HB2 ARG A 70 3.918 -1.894 18.912 1.00 0.00 H new ATOM 0 HB3 ARG A 70 2.743 -3.031 19.545 1.00 0.00 H new ATOM 0 HG2 ARG A 70 3.025 -2.238 21.808 1.00 0.00 H new ATOM 0 HG3 ARG A 70 4.514 -1.400 21.417 1.00 0.00 H new ATOM 0 HD2 ARG A 70 3.209 0.161 19.894 1.00 0.00 H new ATOM 0 HD3 ARG A 70 1.728 -0.653 20.355 1.00 0.00 H new ATOM 0 HE ARG A 70 1.841 0.403 22.515 1.00 0.00 H new ATOM 0 HH11 ARG A 70 4.965 0.502 20.854 1.00 0.00 H new ATOM 0 HH12 ARG A 70 5.703 1.537 22.081 1.00 0.00 H new ATOM 0 HH21 ARG A 70 2.831 1.724 24.052 1.00 0.00 H new ATOM 0 HH22 ARG A 70 4.517 2.214 23.856 1.00 0.00 H new ATOM 1223 N LYS A 71 3.701 -5.764 20.081 1.00 0.00 N ATOM 1224 CA LYS A 71 3.145 -6.957 20.799 1.00 0.00 C ATOM 1225 C LYS A 71 2.074 -6.513 21.805 1.00 0.00 C ATOM 1226 O LYS A 71 2.010 -7.013 22.913 1.00 0.00 O ATOM 1227 CB LYS A 71 4.332 -7.611 21.518 1.00 0.00 C ATOM 1228 CG LYS A 71 4.202 -9.135 21.438 1.00 0.00 C ATOM 1229 CD LYS A 71 5.594 -9.762 21.353 1.00 0.00 C ATOM 1230 CE LYS A 71 5.519 -11.231 21.778 1.00 0.00 C ATOM 1231 NZ LYS A 71 6.926 -11.616 22.080 1.00 0.00 N ATOM 0 H LYS A 71 3.615 -5.794 19.065 1.00 0.00 H new ATOM 0 HA LYS A 71 2.670 -7.658 20.113 1.00 0.00 H new ATOM 0 HB2 LYS A 71 5.269 -7.291 21.061 1.00 0.00 H new ATOM 0 HB3 LYS A 71 4.360 -7.292 22.560 1.00 0.00 H new ATOM 0 HG2 LYS A 71 3.675 -9.512 22.314 1.00 0.00 H new ATOM 0 HG3 LYS A 71 3.612 -9.415 20.566 1.00 0.00 H new ATOM 0 HD2 LYS A 71 5.977 -9.686 20.335 1.00 0.00 H new ATOM 0 HD3 LYS A 71 6.288 -9.221 21.996 1.00 0.00 H new ATOM 0 HE2 LYS A 71 4.879 -11.357 22.651 1.00 0.00 H new ATOM 0 HE3 LYS A 71 5.102 -11.851 20.985 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 6.957 -12.612 22.379 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 7.510 -11.492 21.229 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 7.294 -11.014 22.844 1.00 0.00 H new ATOM 1245 N ALA A 72 1.220 -5.587 21.421 1.00 0.00 N ATOM 1246 CA ALA A 72 0.143 -5.126 22.351 1.00 0.00 C ATOM 1247 C ALA A 72 -1.231 -5.574 21.823 1.00 0.00 C ATOM 1248 O ALA A 72 -2.212 -4.871 21.966 1.00 0.00 O ATOM 1249 CB ALA A 72 0.244 -3.598 22.359 1.00 0.00 C ATOM 0 H ALA A 72 1.226 -5.135 20.507 1.00 0.00 H new ATOM 0 HA ALA A 72 0.255 -5.542 23.352 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -0.517 -3.186 23.022 1.00 0.00 H new ATOM 0 HB2 ALA A 72 1.231 -3.300 22.712 1.00 0.00 H new ATOM 0 HB3 ALA A 72 0.090 -3.218 21.349 1.00 0.00 H new ATOM 1255 N ILE A 73 -1.309 -6.741 21.211 1.00 0.00 N ATOM 1256 CA ILE A 73 -2.621 -7.227 20.676 1.00 0.00 C ATOM 1257 C ILE A 73 -2.606 -8.763 20.566 1.00 0.00 C ATOM 1258 O ILE A 73 -1.551 -9.371 20.573 1.00 0.00 O ATOM 1259 CB ILE A 73 -2.757 -6.573 19.292 1.00 0.00 C ATOM 1260 CG1 ILE A 73 -4.064 -7.027 18.630 1.00 0.00 C ATOM 1261 CG2 ILE A 73 -1.574 -6.970 18.402 1.00 0.00 C ATOM 1262 CD1 ILE A 73 -4.273 -6.263 17.320 1.00 0.00 C ATOM 0 H ILE A 73 -0.521 -7.372 21.062 1.00 0.00 H new ATOM 0 HA ILE A 73 -3.459 -6.967 21.322 1.00 0.00 H new ATOM 0 HB ILE A 73 -2.766 -5.490 19.415 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -4.031 -8.099 18.435 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -4.904 -6.851 19.303 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -1.681 -6.501 17.424 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -0.644 -6.638 18.864 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -1.555 -8.053 18.285 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -5.203 -6.589 16.853 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -4.326 -5.194 17.527 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -3.440 -6.461 16.646 1.00 0.00 H new ATOM 1274 N SER A 74 -3.755 -9.396 20.463 1.00 0.00 N ATOM 1275 CA SER A 74 -3.770 -10.887 20.354 1.00 0.00 C ATOM 1276 C SER A 74 -4.171 -11.311 18.934 1.00 0.00 C ATOM 1277 O SER A 74 -4.916 -10.618 18.268 1.00 0.00 O ATOM 1278 CB SER A 74 -4.813 -11.360 21.369 1.00 0.00 C ATOM 1279 OG SER A 74 -4.465 -10.877 22.660 1.00 0.00 O ATOM 0 H SER A 74 -4.671 -8.947 20.450 1.00 0.00 H new ATOM 0 HA SER A 74 -2.790 -11.320 20.552 1.00 0.00 H new ATOM 0 HB2 SER A 74 -5.802 -10.998 21.087 1.00 0.00 H new ATOM 0 HB3 SER A 74 -4.862 -12.449 21.377 1.00 0.00 H new ATOM 0 HG SER A 74 -5.132 -11.177 23.312 1.00 0.00 H new ATOM 1285 N LYS A 75 -3.679 -12.444 18.460 1.00 0.00 N ATOM 1286 CA LYS A 75 -4.039 -12.913 17.065 1.00 0.00 C ATOM 1287 C LYS A 75 -5.557 -12.810 16.809 1.00 0.00 C ATOM 1288 O LYS A 75 -5.975 -12.565 15.695 1.00 0.00 O ATOM 1289 CB LYS A 75 -3.598 -14.382 16.973 1.00 0.00 C ATOM 1290 CG LYS A 75 -3.425 -14.772 15.503 1.00 0.00 C ATOM 1291 CD LYS A 75 -2.340 -15.843 15.383 1.00 0.00 C ATOM 1292 CE LYS A 75 -1.765 -15.831 13.965 1.00 0.00 C ATOM 1293 NZ LYS A 75 -0.505 -16.622 14.055 1.00 0.00 N ATOM 0 H LYS A 75 -3.049 -13.061 18.973 1.00 0.00 H new ATOM 0 HA LYS A 75 -3.546 -12.290 16.319 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -2.661 -14.526 17.511 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -4.339 -15.026 17.446 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -4.367 -15.147 15.102 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -3.153 -13.897 14.913 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -1.549 -15.657 16.109 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -2.756 -16.825 15.610 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -2.460 -16.275 13.253 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -1.569 -14.813 13.627 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -0.051 -16.660 13.120 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 0.140 -16.171 14.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -0.723 -17.588 14.373 1.00 0.00 H new ATOM 1307 N ASP A 76 -6.388 -12.988 17.822 1.00 0.00 N ATOM 1308 CA ASP A 76 -7.872 -12.879 17.586 1.00 0.00 C ATOM 1309 C ASP A 76 -8.210 -11.458 17.115 1.00 0.00 C ATOM 1310 O ASP A 76 -8.867 -11.281 16.105 1.00 0.00 O ATOM 1311 CB ASP A 76 -8.565 -13.177 18.927 1.00 0.00 C ATOM 1312 CG ASP A 76 -8.688 -14.691 19.112 1.00 0.00 C ATOM 1313 OD1 ASP A 76 -7.664 -15.354 19.105 1.00 0.00 O ATOM 1314 OD2 ASP A 76 -9.803 -15.160 19.258 1.00 0.00 O ATOM 0 H ASP A 76 -6.109 -13.199 18.780 1.00 0.00 H new ATOM 0 HA ASP A 76 -8.206 -13.579 16.820 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -7.993 -12.745 19.748 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -9.552 -12.716 18.949 1.00 0.00 H new ATOM 1319 N LEU A 77 -7.751 -10.440 17.820 1.00 0.00 N ATOM 1320 CA LEU A 77 -8.049 -9.038 17.361 1.00 0.00 C ATOM 1321 C LEU A 77 -7.314 -8.793 16.038 1.00 0.00 C ATOM 1322 O LEU A 77 -7.879 -8.262 15.100 1.00 0.00 O ATOM 1323 CB LEU A 77 -7.532 -8.079 18.450 1.00 0.00 C ATOM 1324 CG LEU A 77 -7.821 -6.630 18.037 1.00 0.00 C ATOM 1325 CD1 LEU A 77 -9.326 -6.365 18.119 1.00 0.00 C ATOM 1326 CD2 LEU A 77 -7.075 -5.663 18.970 1.00 0.00 C ATOM 0 H LEU A 77 -7.196 -10.517 18.673 1.00 0.00 H new ATOM 0 HA LEU A 77 -9.116 -8.881 17.204 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -8.014 -8.300 19.402 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -6.461 -8.220 18.595 1.00 0.00 H new ATOM 0 HG LEU A 77 -7.480 -6.474 17.014 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -9.531 -5.335 17.825 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -9.852 -7.045 17.449 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -9.669 -6.526 19.141 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -7.284 -4.636 18.672 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -7.408 -5.818 19.996 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -6.003 -5.849 18.905 1.00 0.00 H new ATOM 1338 N TYR A 78 -6.060 -9.198 15.944 1.00 0.00 N ATOM 1339 CA TYR A 78 -5.308 -8.999 14.654 1.00 0.00 C ATOM 1340 C TYR A 78 -6.029 -9.750 13.520 1.00 0.00 C ATOM 1341 O TYR A 78 -6.134 -9.249 12.414 1.00 0.00 O ATOM 1342 CB TYR A 78 -3.889 -9.564 14.879 1.00 0.00 C ATOM 1343 CG TYR A 78 -3.067 -9.462 13.607 1.00 0.00 C ATOM 1344 CD1 TYR A 78 -3.080 -8.285 12.847 1.00 0.00 C ATOM 1345 CD2 TYR A 78 -2.290 -10.550 13.193 1.00 0.00 C ATOM 1346 CE1 TYR A 78 -2.317 -8.197 11.676 1.00 0.00 C ATOM 1347 CE2 TYR A 78 -1.525 -10.462 12.023 1.00 0.00 C ATOM 1348 CZ TYR A 78 -1.540 -9.285 11.264 1.00 0.00 C ATOM 1349 OH TYR A 78 -0.788 -9.200 10.111 1.00 0.00 O ATOM 0 H TYR A 78 -5.534 -9.650 16.692 1.00 0.00 H new ATOM 0 HA TYR A 78 -5.256 -7.948 14.371 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -3.396 -9.016 15.682 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -3.952 -10.605 15.196 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -3.679 -7.445 13.165 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -2.280 -11.459 13.777 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -2.328 -7.289 11.091 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -0.924 -11.301 11.706 1.00 0.00 H new ATOM 0 HH TYR A 78 -0.308 -10.043 9.971 1.00 0.00 H new ATOM 1359 N ASP A 79 -6.558 -10.933 13.786 1.00 0.00 N ATOM 1360 CA ASP A 79 -7.298 -11.673 12.704 1.00 0.00 C ATOM 1361 C ASP A 79 -8.644 -10.975 12.464 1.00 0.00 C ATOM 1362 O ASP A 79 -9.050 -10.772 11.336 1.00 0.00 O ATOM 1363 CB ASP A 79 -7.518 -13.106 13.213 1.00 0.00 C ATOM 1364 CG ASP A 79 -7.881 -14.016 12.039 1.00 0.00 C ATOM 1365 OD1 ASP A 79 -7.280 -13.863 10.988 1.00 0.00 O ATOM 1366 OD2 ASP A 79 -8.755 -14.850 12.209 1.00 0.00 O ATOM 0 H ASP A 79 -6.510 -11.408 14.688 1.00 0.00 H new ATOM 0 HA ASP A 79 -6.743 -11.687 11.766 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -6.616 -13.471 13.704 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -8.314 -13.120 13.957 1.00 0.00 H new ATOM 1371 N TRP A 80 -9.331 -10.580 13.522 1.00 0.00 N ATOM 1372 CA TRP A 80 -10.648 -9.865 13.340 1.00 0.00 C ATOM 1373 C TRP A 80 -10.435 -8.600 12.487 1.00 0.00 C ATOM 1374 O TRP A 80 -11.267 -8.259 11.667 1.00 0.00 O ATOM 1375 CB TRP A 80 -11.137 -9.489 14.752 1.00 0.00 C ATOM 1376 CG TRP A 80 -12.455 -8.783 14.675 1.00 0.00 C ATOM 1377 CD1 TRP A 80 -13.648 -9.383 14.463 1.00 0.00 C ATOM 1378 CD2 TRP A 80 -12.732 -7.358 14.811 1.00 0.00 C ATOM 1379 NE1 TRP A 80 -14.640 -8.417 14.459 1.00 0.00 N ATOM 1380 CE2 TRP A 80 -14.124 -7.154 14.670 1.00 0.00 C ATOM 1381 CE3 TRP A 80 -11.917 -6.235 15.041 1.00 0.00 C ATOM 1382 CZ2 TRP A 80 -14.687 -5.880 14.753 1.00 0.00 C ATOM 1383 CZ3 TRP A 80 -12.481 -4.952 15.124 1.00 0.00 C ATOM 1384 CH2 TRP A 80 -13.863 -4.774 14.980 1.00 0.00 C ATOM 0 H TRP A 80 -9.042 -10.719 14.490 1.00 0.00 H new ATOM 0 HA TRP A 80 -11.381 -10.490 12.829 1.00 0.00 H new ATOM 0 HB2 TRP A 80 -11.233 -10.387 15.362 1.00 0.00 H new ATOM 0 HB3 TRP A 80 -10.402 -8.849 15.240 1.00 0.00 H new ATOM 0 HD1 TRP A 80 -13.802 -10.442 14.320 1.00 0.00 H new ATOM 0 HE1 TRP A 80 -15.631 -8.614 14.317 1.00 0.00 H new ATOM 0 HE3 TRP A 80 -10.850 -6.360 15.155 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 -15.753 -5.749 14.642 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 -11.845 -4.097 15.300 1.00 0.00 H new ATOM 0 HH2 TRP A 80 -14.291 -3.784 15.044 1.00 0.00 H new ATOM 1395 N LEU A 81 -9.321 -7.909 12.660 1.00 0.00 N ATOM 1396 CA LEU A 81 -9.075 -6.678 11.828 1.00 0.00 C ATOM 1397 C LEU A 81 -8.867 -7.094 10.363 1.00 0.00 C ATOM 1398 O LEU A 81 -9.511 -6.577 9.470 1.00 0.00 O ATOM 1399 CB LEU A 81 -7.796 -6.017 12.373 1.00 0.00 C ATOM 1400 CG LEU A 81 -8.003 -5.601 13.832 1.00 0.00 C ATOM 1401 CD1 LEU A 81 -6.651 -5.571 14.550 1.00 0.00 C ATOM 1402 CD2 LEU A 81 -8.629 -4.208 13.878 1.00 0.00 C ATOM 0 H LEU A 81 -8.586 -8.140 13.328 1.00 0.00 H new ATOM 0 HA LEU A 81 -9.917 -5.987 11.877 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -6.958 -6.711 12.299 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.542 -5.145 11.770 1.00 0.00 H new ATOM 0 HG LEU A 81 -8.663 -6.316 14.324 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -6.797 -5.275 15.589 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -6.199 -6.562 14.515 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -5.993 -4.855 14.058 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -8.777 -3.910 14.916 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -7.967 -3.495 13.387 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -9.590 -4.224 13.364 1.00 0.00 H new ATOM 1414 N ILE A 82 -7.978 -8.037 10.109 1.00 0.00 N ATOM 1415 CA ILE A 82 -7.746 -8.486 8.687 1.00 0.00 C ATOM 1416 C ILE A 82 -9.070 -8.986 8.061 1.00 0.00 C ATOM 1417 O ILE A 82 -9.274 -8.855 6.869 1.00 0.00 O ATOM 1418 CB ILE A 82 -6.704 -9.633 8.744 1.00 0.00 C ATOM 1419 CG1 ILE A 82 -5.348 -9.096 9.243 1.00 0.00 C ATOM 1420 CG2 ILE A 82 -6.515 -10.253 7.351 1.00 0.00 C ATOM 1421 CD1 ILE A 82 -4.832 -7.987 8.316 1.00 0.00 C ATOM 0 H ILE A 82 -7.411 -8.509 10.813 1.00 0.00 H new ATOM 0 HA ILE A 82 -7.384 -7.664 8.070 1.00 0.00 H new ATOM 0 HB ILE A 82 -7.072 -10.394 9.433 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -5.454 -8.710 10.257 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -4.623 -9.908 9.286 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -5.781 -11.057 7.407 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -7.466 -10.654 6.999 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -6.164 -9.489 6.657 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -3.874 -7.621 8.685 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -4.705 -8.384 7.309 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -5.550 -7.167 8.295 1.00 0.00 H new ATOM 1433 N LYS A 83 -9.968 -9.559 8.845 1.00 0.00 N ATOM 1434 CA LYS A 83 -11.263 -10.057 8.253 1.00 0.00 C ATOM 1435 C LYS A 83 -12.361 -8.969 8.250 1.00 0.00 C ATOM 1436 O LYS A 83 -13.375 -9.136 7.597 1.00 0.00 O ATOM 1437 CB LYS A 83 -11.704 -11.249 9.118 1.00 0.00 C ATOM 1438 CG LYS A 83 -11.165 -12.547 8.515 1.00 0.00 C ATOM 1439 CD LYS A 83 -9.640 -12.575 8.637 1.00 0.00 C ATOM 1440 CE LYS A 83 -9.094 -13.813 7.922 1.00 0.00 C ATOM 1441 NZ LYS A 83 -9.033 -14.868 8.970 1.00 0.00 N ATOM 0 H LYS A 83 -9.863 -9.701 9.850 1.00 0.00 H new ATOM 0 HA LYS A 83 -11.111 -10.340 7.211 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -11.335 -11.129 10.137 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -12.792 -11.287 9.175 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -11.597 -13.406 9.029 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -11.458 -12.622 7.468 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -9.213 -11.672 8.201 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -9.349 -12.590 9.687 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -9.743 -14.112 7.099 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -8.109 -13.621 7.497 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -8.748 -15.770 8.538 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -8.339 -14.597 9.695 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -9.969 -14.975 9.410 1.00 0.00 H new ATOM 1455 N GLU A 84 -12.192 -7.864 8.959 1.00 0.00 N ATOM 1456 CA GLU A 84 -13.265 -6.809 8.955 1.00 0.00 C ATOM 1457 C GLU A 84 -12.833 -5.546 8.170 1.00 0.00 C ATOM 1458 O GLU A 84 -13.362 -4.475 8.395 1.00 0.00 O ATOM 1459 CB GLU A 84 -13.481 -6.465 10.419 1.00 0.00 C ATOM 1460 CG GLU A 84 -14.073 -7.664 11.154 1.00 0.00 C ATOM 1461 CD GLU A 84 -15.475 -7.958 10.615 1.00 0.00 C ATOM 1462 OE1 GLU A 84 -16.254 -7.025 10.507 1.00 0.00 O ATOM 1463 OE2 GLU A 84 -15.746 -9.111 10.320 1.00 0.00 O ATOM 0 H GLU A 84 -11.373 -7.653 9.529 1.00 0.00 H new ATOM 0 HA GLU A 84 -14.169 -7.172 8.466 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -12.535 -6.178 10.877 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -14.150 -5.609 10.505 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -13.432 -8.536 11.023 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -14.119 -7.460 12.224 1.00 0.00 H new ATOM 1470 N LYS A 85 -11.888 -5.664 7.251 1.00 0.00 N ATOM 1471 CA LYS A 85 -11.412 -4.492 6.422 1.00 0.00 C ATOM 1472 C LYS A 85 -10.522 -3.546 7.236 1.00 0.00 C ATOM 1473 O LYS A 85 -10.930 -2.463 7.608 1.00 0.00 O ATOM 1474 CB LYS A 85 -12.658 -3.761 5.894 1.00 0.00 C ATOM 1475 CG LYS A 85 -12.419 -3.315 4.449 1.00 0.00 C ATOM 1476 CD LYS A 85 -11.310 -2.260 4.415 1.00 0.00 C ATOM 1477 CE LYS A 85 -9.967 -2.937 4.129 1.00 0.00 C ATOM 1478 NZ LYS A 85 -9.266 -2.015 3.191 1.00 0.00 N ATOM 0 H LYS A 85 -11.417 -6.543 7.037 1.00 0.00 H new ATOM 0 HA LYS A 85 -10.800 -4.849 5.594 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -13.526 -4.419 5.943 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -12.877 -2.896 6.520 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -12.140 -4.171 3.835 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -13.337 -2.906 4.027 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -11.525 -1.516 3.648 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -11.267 -1.732 5.367 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -9.394 -3.080 5.045 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -10.108 -3.922 3.684 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -8.335 -2.410 2.947 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -9.832 -1.903 2.326 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -9.140 -1.088 3.645 1.00 0.00 H new ATOM 1492 N TYR A 86 -9.296 -3.949 7.503 1.00 0.00 N ATOM 1493 CA TYR A 86 -8.364 -3.083 8.278 1.00 0.00 C ATOM 1494 C TYR A 86 -6.998 -3.062 7.582 1.00 0.00 C ATOM 1495 O TYR A 86 -6.545 -2.031 7.123 1.00 0.00 O ATOM 1496 CB TYR A 86 -8.255 -3.746 9.651 1.00 0.00 C ATOM 1497 CG TYR A 86 -9.486 -3.428 10.464 1.00 0.00 C ATOM 1498 CD1 TYR A 86 -10.715 -4.033 10.157 1.00 0.00 C ATOM 1499 CD2 TYR A 86 -9.394 -2.526 11.529 1.00 0.00 C ATOM 1500 CE1 TYR A 86 -11.849 -3.724 10.924 1.00 0.00 C ATOM 1501 CE2 TYR A 86 -10.525 -2.222 12.291 1.00 0.00 C ATOM 1502 CZ TYR A 86 -11.753 -2.820 11.989 1.00 0.00 C ATOM 1503 OH TYR A 86 -12.870 -2.520 12.741 1.00 0.00 O ATOM 0 H TYR A 86 -8.907 -4.846 7.212 1.00 0.00 H new ATOM 0 HA TYR A 86 -8.710 -2.052 8.356 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -8.150 -4.825 9.538 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -7.363 -3.391 10.168 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -10.787 -4.731 9.336 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -8.447 -2.063 11.763 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -12.798 -4.185 10.692 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -10.451 -1.525 13.113 1.00 0.00 H new ATOM 0 HH TYR A 86 -12.602 -2.334 13.665 1.00 0.00 H new ATOM 1513 N ALA A 87 -6.346 -4.198 7.490 1.00 0.00 N ATOM 1514 CA ALA A 87 -5.019 -4.257 6.813 1.00 0.00 C ATOM 1515 C ALA A 87 -5.009 -5.419 5.810 1.00 0.00 C ATOM 1516 O ALA A 87 -5.849 -6.297 5.875 1.00 0.00 O ATOM 1517 CB ALA A 87 -4.009 -4.501 7.935 1.00 0.00 C ATOM 0 H ALA A 87 -6.681 -5.088 7.858 1.00 0.00 H new ATOM 0 HA ALA A 87 -4.788 -3.347 6.259 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -3.005 -4.557 7.515 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -4.057 -3.682 8.652 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -4.244 -5.439 8.439 1.00 0.00 H new ATOM 1523 N ASP A 88 -4.076 -5.438 4.881 1.00 0.00 N ATOM 1524 CA ASP A 88 -4.041 -6.557 3.887 1.00 0.00 C ATOM 1525 C ASP A 88 -2.856 -7.492 4.174 1.00 0.00 C ATOM 1526 O ASP A 88 -1.715 -7.135 3.953 1.00 0.00 O ATOM 1527 CB ASP A 88 -3.878 -5.885 2.521 1.00 0.00 C ATOM 1528 CG ASP A 88 -3.909 -6.947 1.420 1.00 0.00 C ATOM 1529 OD1 ASP A 88 -3.073 -7.835 1.459 1.00 0.00 O ATOM 1530 OD2 ASP A 88 -4.767 -6.855 0.558 1.00 0.00 O ATOM 0 H ASP A 88 -3.346 -4.734 4.771 1.00 0.00 H new ATOM 0 HA ASP A 88 -4.943 -7.167 3.931 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -4.676 -5.160 2.363 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -2.937 -5.336 2.484 1.00 0.00 H new ATOM 1535 N LYS A 89 -3.116 -8.690 4.662 1.00 0.00 N ATOM 1536 CA LYS A 89 -1.982 -9.640 4.952 1.00 0.00 C ATOM 1537 C LYS A 89 -1.174 -9.909 3.671 1.00 0.00 C ATOM 1538 O LYS A 89 0.037 -10.028 3.716 1.00 0.00 O ATOM 1539 CB LYS A 89 -2.616 -10.947 5.458 1.00 0.00 C ATOM 1540 CG LYS A 89 -2.804 -10.870 6.975 1.00 0.00 C ATOM 1541 CD LYS A 89 -1.611 -11.526 7.674 1.00 0.00 C ATOM 1542 CE LYS A 89 -1.677 -13.044 7.486 1.00 0.00 C ATOM 1543 NZ LYS A 89 -1.237 -13.613 8.789 1.00 0.00 N ATOM 0 H LYS A 89 -4.049 -9.047 4.869 1.00 0.00 H new ATOM 0 HA LYS A 89 -1.302 -9.220 5.693 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -3.577 -11.110 4.970 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -1.980 -11.795 5.202 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -2.895 -9.830 7.288 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -3.728 -11.371 7.263 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -0.678 -11.139 7.264 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -1.619 -11.280 8.736 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -2.687 -13.367 7.235 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -1.027 -13.370 6.674 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -1.256 -14.652 8.738 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -0.269 -13.294 8.998 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -1.878 -13.292 9.542 1.00 0.00 H new ATOM 1557 N LEU A 90 -1.828 -10.008 2.526 1.00 0.00 N ATOM 1558 CA LEU A 90 -1.062 -10.272 1.254 1.00 0.00 C ATOM 1559 C LEU A 90 -0.032 -9.157 1.014 1.00 0.00 C ATOM 1560 O LEU A 90 1.076 -9.425 0.586 1.00 0.00 O ATOM 1561 CB LEU A 90 -2.089 -10.299 0.110 1.00 0.00 C ATOM 1562 CG LEU A 90 -1.444 -10.900 -1.140 1.00 0.00 C ATOM 1563 CD1 LEU A 90 -1.193 -12.393 -0.918 1.00 0.00 C ATOM 1564 CD2 LEU A 90 -2.381 -10.714 -2.336 1.00 0.00 C ATOM 0 H LEU A 90 -2.838 -9.919 2.419 1.00 0.00 H new ATOM 0 HA LEU A 90 -0.521 -11.216 1.315 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -2.959 -10.887 0.402 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -2.442 -9.289 -0.100 1.00 0.00 H new ATOM 0 HG LEU A 90 -0.497 -10.398 -1.337 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -0.733 -12.821 -1.809 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -0.527 -12.527 -0.066 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -2.140 -12.896 -0.721 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -1.922 -11.142 -3.227 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -3.328 -11.217 -2.138 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -2.561 -9.651 -2.495 1.00 0.00 H new ATOM 1576 N LEU A 91 -0.373 -7.913 1.296 1.00 0.00 N ATOM 1577 CA LEU A 91 0.630 -6.812 1.081 1.00 0.00 C ATOM 1578 C LEU A 91 1.732 -6.931 2.140 1.00 0.00 C ATOM 1579 O LEU A 91 2.906 -6.865 1.821 1.00 0.00 O ATOM 1580 CB LEU A 91 -0.117 -5.474 1.219 1.00 0.00 C ATOM 1581 CG LEU A 91 0.860 -4.309 0.992 1.00 0.00 C ATOM 1582 CD1 LEU A 91 1.464 -4.393 -0.414 1.00 0.00 C ATOM 1583 CD2 LEU A 91 0.110 -2.984 1.140 1.00 0.00 C ATOM 0 H LEU A 91 -1.280 -7.619 1.657 1.00 0.00 H new ATOM 0 HA LEU A 91 1.092 -6.876 0.096 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -0.931 -5.425 0.496 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -0.566 -5.397 2.209 1.00 0.00 H new ATOM 0 HG LEU A 91 1.661 -4.368 1.729 1.00 0.00 H new ATOM 0 HD11 LEU A 91 2.154 -3.563 -0.564 1.00 0.00 H new ATOM 0 HD12 LEU A 91 2.000 -5.335 -0.524 1.00 0.00 H new ATOM 0 HD13 LEU A 91 0.667 -4.340 -1.156 1.00 0.00 H new ATOM 0 HD21 LEU A 91 0.800 -2.156 0.980 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -0.692 -2.936 0.404 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -0.313 -2.915 2.142 1.00 0.00 H new ATOM 1595 N ILE A 92 1.374 -7.138 3.395 1.00 0.00 N ATOM 1596 CA ILE A 92 2.438 -7.296 4.450 1.00 0.00 C ATOM 1597 C ILE A 92 3.302 -8.526 4.091 1.00 0.00 C ATOM 1598 O ILE A 92 4.509 -8.498 4.235 1.00 0.00 O ATOM 1599 CB ILE A 92 1.706 -7.470 5.807 1.00 0.00 C ATOM 1600 CG1 ILE A 92 1.147 -6.101 6.241 1.00 0.00 C ATOM 1601 CG2 ILE A 92 2.676 -7.994 6.881 1.00 0.00 C ATOM 1602 CD1 ILE A 92 0.492 -6.192 7.629 1.00 0.00 C ATOM 0 H ILE A 92 0.412 -7.203 3.728 1.00 0.00 H new ATOM 0 HA ILE A 92 3.102 -6.434 4.512 1.00 0.00 H new ATOM 0 HB ILE A 92 0.897 -8.192 5.692 1.00 0.00 H new ATOM 0 HG12 ILE A 92 1.951 -5.365 6.261 1.00 0.00 H new ATOM 0 HG13 ILE A 92 0.416 -5.754 5.511 1.00 0.00 H new ATOM 0 HG21 ILE A 92 2.145 -8.110 7.826 1.00 0.00 H new ATOM 0 HG22 ILE A 92 3.077 -8.959 6.570 1.00 0.00 H new ATOM 0 HG23 ILE A 92 3.494 -7.285 7.009 1.00 0.00 H new ATOM 0 HD11 ILE A 92 0.105 -5.214 7.914 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -0.327 -6.911 7.599 1.00 0.00 H new ATOM 0 HD13 ILE A 92 1.233 -6.516 8.360 1.00 0.00 H new ATOM 1614 N ALA A 93 2.697 -9.594 3.598 1.00 0.00 N ATOM 1615 CA ALA A 93 3.517 -10.798 3.212 1.00 0.00 C ATOM 1616 C ALA A 93 4.482 -10.415 2.077 1.00 0.00 C ATOM 1617 O ALA A 93 5.625 -10.832 2.069 1.00 0.00 O ATOM 1618 CB ALA A 93 2.533 -11.875 2.732 1.00 0.00 C ATOM 0 H ALA A 93 1.692 -9.682 3.449 1.00 0.00 H new ATOM 0 HA ALA A 93 4.107 -11.165 4.052 1.00 0.00 H new ATOM 0 HB1 ALA A 93 3.085 -12.769 2.441 1.00 0.00 H new ATOM 0 HB2 ALA A 93 1.842 -12.122 3.538 1.00 0.00 H new ATOM 0 HB3 ALA A 93 1.972 -11.500 1.876 1.00 0.00 H new ATOM 1624 N LYS A 94 4.039 -9.614 1.121 1.00 0.00 N ATOM 1625 CA LYS A 94 4.964 -9.208 -0.002 1.00 0.00 C ATOM 1626 C LYS A 94 6.182 -8.477 0.583 1.00 0.00 C ATOM 1627 O LYS A 94 7.312 -8.777 0.244 1.00 0.00 O ATOM 1628 CB LYS A 94 4.173 -8.253 -0.913 1.00 0.00 C ATOM 1629 CG LYS A 94 3.307 -9.055 -1.886 1.00 0.00 C ATOM 1630 CD LYS A 94 4.200 -9.876 -2.819 1.00 0.00 C ATOM 1631 CE LYS A 94 3.517 -10.015 -4.181 1.00 0.00 C ATOM 1632 NZ LYS A 94 2.777 -11.305 -4.111 1.00 0.00 N ATOM 0 H LYS A 94 3.095 -9.231 1.070 1.00 0.00 H new ATOM 0 HA LYS A 94 5.314 -10.076 -0.560 1.00 0.00 H new ATOM 0 HB2 LYS A 94 3.545 -7.598 -0.309 1.00 0.00 H new ATOM 0 HB3 LYS A 94 4.860 -7.613 -1.467 1.00 0.00 H new ATOM 0 HG2 LYS A 94 2.639 -9.715 -1.333 1.00 0.00 H new ATOM 0 HG3 LYS A 94 2.679 -8.381 -2.469 1.00 0.00 H new ATOM 0 HD2 LYS A 94 5.169 -9.391 -2.933 1.00 0.00 H new ATOM 0 HD3 LYS A 94 4.385 -10.861 -2.390 1.00 0.00 H new ATOM 0 HE2 LYS A 94 2.840 -9.182 -4.370 1.00 0.00 H new ATOM 0 HE3 LYS A 94 4.248 -10.022 -4.990 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 2.201 -11.422 -4.969 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 3.455 -12.091 -4.039 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 2.157 -11.305 -3.276 1.00 0.00 H new ATOM 1646 N TRP A 95 5.961 -7.525 1.468 1.00 0.00 N ATOM 1647 CA TRP A 95 7.126 -6.787 2.077 1.00 0.00 C ATOM 1648 C TRP A 95 8.052 -7.770 2.815 1.00 0.00 C ATOM 1649 O TRP A 95 9.257 -7.601 2.819 1.00 0.00 O ATOM 1650 CB TRP A 95 6.537 -5.768 3.071 1.00 0.00 C ATOM 1651 CG TRP A 95 6.174 -4.499 2.357 1.00 0.00 C ATOM 1652 CD1 TRP A 95 6.923 -3.896 1.403 1.00 0.00 C ATOM 1653 CD2 TRP A 95 4.989 -3.666 2.529 1.00 0.00 C ATOM 1654 NE1 TRP A 95 6.277 -2.748 0.984 1.00 0.00 N ATOM 1655 CE2 TRP A 95 5.082 -2.565 1.646 1.00 0.00 C ATOM 1656 CE3 TRP A 95 3.856 -3.758 3.356 1.00 0.00 C ATOM 1657 CZ2 TRP A 95 4.088 -1.589 1.584 1.00 0.00 C ATOM 1658 CZ3 TRP A 95 2.851 -2.776 3.296 1.00 0.00 C ATOM 1659 CH2 TRP A 95 2.969 -1.693 2.410 1.00 0.00 C ATOM 0 H TRP A 95 5.040 -7.230 1.791 1.00 0.00 H new ATOM 0 HA TRP A 95 7.716 -6.289 1.308 1.00 0.00 H new ATOM 0 HB2 TRP A 95 5.654 -6.188 3.553 1.00 0.00 H new ATOM 0 HB3 TRP A 95 7.261 -5.557 3.858 1.00 0.00 H new ATOM 0 HD1 TRP A 95 7.871 -4.254 1.030 1.00 0.00 H new ATOM 0 HE1 TRP A 95 6.640 -2.114 0.272 1.00 0.00 H new ATOM 0 HE3 TRP A 95 3.757 -4.587 4.041 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 4.184 -0.758 0.901 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 1.984 -2.855 3.935 1.00 0.00 H new ATOM 0 HH2 TRP A 95 2.194 -0.942 2.368 1.00 0.00 H new ATOM 1670 N ARG A 96 7.506 -8.797 3.436 1.00 0.00 N ATOM 1671 CA ARG A 96 8.381 -9.784 4.165 1.00 0.00 C ATOM 1672 C ARG A 96 8.974 -10.815 3.186 1.00 0.00 C ATOM 1673 O ARG A 96 10.080 -11.283 3.380 1.00 0.00 O ATOM 1674 CB ARG A 96 7.481 -10.486 5.196 1.00 0.00 C ATOM 1675 CG ARG A 96 7.386 -9.632 6.469 1.00 0.00 C ATOM 1676 CD ARG A 96 5.935 -9.599 6.966 1.00 0.00 C ATOM 1677 NE ARG A 96 5.580 -11.027 7.230 1.00 0.00 N ATOM 1678 CZ ARG A 96 6.022 -11.659 8.306 1.00 0.00 C ATOM 1679 NH1 ARG A 96 6.788 -11.057 9.187 1.00 0.00 N ATOM 1680 NH2 ARG A 96 5.691 -12.909 8.503 1.00 0.00 N ATOM 0 H ARG A 96 6.506 -8.994 3.470 1.00 0.00 H new ATOM 0 HA ARG A 96 9.218 -9.279 4.647 1.00 0.00 H new ATOM 0 HB2 ARG A 96 6.487 -10.643 4.777 1.00 0.00 H new ATOM 0 HB3 ARG A 96 7.885 -11.469 5.436 1.00 0.00 H new ATOM 0 HG2 ARG A 96 8.036 -10.042 7.242 1.00 0.00 H new ATOM 0 HG3 ARG A 96 7.733 -8.619 6.265 1.00 0.00 H new ATOM 0 HD2 ARG A 96 5.842 -8.996 7.869 1.00 0.00 H new ATOM 0 HD3 ARG A 96 5.273 -9.160 6.220 1.00 0.00 H new ATOM 0 HE ARG A 96 4.985 -11.525 6.568 1.00 0.00 H new ATOM 0 HH11 ARG A 96 7.054 -10.082 9.050 1.00 0.00 H new ATOM 0 HH12 ARG A 96 7.116 -11.564 10.009 1.00 0.00 H new ATOM 0 HH21 ARG A 96 5.096 -13.391 7.830 1.00 0.00 H new ATOM 0 HH22 ARG A 96 6.028 -13.402 9.330 1.00 0.00 H new ATOM 1694 N LYS A 97 8.255 -11.179 2.139 1.00 0.00 N ATOM 1695 CA LYS A 97 8.806 -12.193 1.158 1.00 0.00 C ATOM 1696 C LYS A 97 10.210 -11.784 0.678 1.00 0.00 C ATOM 1697 O LYS A 97 10.714 -10.739 1.044 1.00 0.00 O ATOM 1698 CB LYS A 97 7.847 -12.210 -0.044 1.00 0.00 C ATOM 1699 CG LYS A 97 6.747 -13.250 0.178 1.00 0.00 C ATOM 1700 CD LYS A 97 7.366 -14.649 0.226 1.00 0.00 C ATOM 1701 CE LYS A 97 6.313 -15.687 -0.171 1.00 0.00 C ATOM 1702 NZ LYS A 97 7.049 -16.684 -0.997 1.00 0.00 N ATOM 0 H LYS A 97 7.323 -10.825 1.921 1.00 0.00 H new ATOM 0 HA LYS A 97 8.886 -13.172 1.630 1.00 0.00 H new ATOM 0 HB2 LYS A 97 7.404 -11.223 -0.180 1.00 0.00 H new ATOM 0 HB3 LYS A 97 8.398 -12.440 -0.956 1.00 0.00 H new ATOM 0 HG2 LYS A 97 6.219 -13.043 1.109 1.00 0.00 H new ATOM 0 HG3 LYS A 97 6.012 -13.194 -0.625 1.00 0.00 H new ATOM 0 HD2 LYS A 97 8.219 -14.704 -0.450 1.00 0.00 H new ATOM 0 HD3 LYS A 97 7.739 -14.859 1.228 1.00 0.00 H new ATOM 0 HE2 LYS A 97 5.868 -16.154 0.708 1.00 0.00 H new ATOM 0 HE3 LYS A 97 5.500 -15.229 -0.735 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 6.393 -17.429 -1.308 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 7.456 -16.212 -1.830 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 7.812 -17.108 -0.431 1.00 0.00 H new ATOM 1716 N THR A 98 10.838 -12.592 -0.152 1.00 0.00 N ATOM 1717 CA THR A 98 12.199 -12.231 -0.663 1.00 0.00 C ATOM 1718 C THR A 98 12.090 -11.773 -2.124 1.00 0.00 C ATOM 1719 O THR A 98 11.326 -12.332 -2.891 1.00 0.00 O ATOM 1720 CB THR A 98 13.036 -13.510 -0.557 1.00 0.00 C ATOM 1721 OG1 THR A 98 12.944 -14.027 0.763 1.00 0.00 O ATOM 1722 CG2 THR A 98 14.496 -13.197 -0.885 1.00 0.00 C ATOM 0 H THR A 98 10.467 -13.479 -0.493 1.00 0.00 H new ATOM 0 HA THR A 98 12.652 -11.418 -0.096 1.00 0.00 H new ATOM 0 HB THR A 98 12.659 -14.250 -1.264 1.00 0.00 H new ATOM 0 HG1 THR A 98 13.478 -14.846 0.831 1.00 0.00 H new ATOM 0 HG21 THR A 98 15.089 -14.108 -0.809 1.00 0.00 H new ATOM 0 HG22 THR A 98 14.565 -12.803 -1.899 1.00 0.00 H new ATOM 0 HG23 THR A 98 14.876 -12.457 -0.181 1.00 0.00 H new ATOM 1730 N GLY A 99 12.829 -10.756 -2.517 1.00 0.00 N ATOM 1731 CA GLY A 99 12.735 -10.274 -3.928 1.00 0.00 C ATOM 1732 C GLY A 99 11.852 -9.010 -4.009 1.00 0.00 C ATOM 1733 O GLY A 99 11.978 -8.237 -4.941 1.00 0.00 O ATOM 0 H GLY A 99 13.485 -10.247 -1.925 1.00 0.00 H new ATOM 0 HA2 GLY A 99 13.732 -10.054 -4.311 1.00 0.00 H new ATOM 0 HA3 GLY A 99 12.317 -11.058 -4.559 1.00 0.00 H new ATOM 1737 N TYR A 100 10.964 -8.780 -3.053 1.00 0.00 N ATOM 1738 CA TYR A 100 10.100 -7.550 -3.118 1.00 0.00 C ATOM 1739 C TYR A 100 10.778 -6.388 -2.368 1.00 0.00 C ATOM 1740 O TYR A 100 10.217 -5.838 -1.435 1.00 0.00 O ATOM 1741 CB TYR A 100 8.775 -7.917 -2.434 1.00 0.00 C ATOM 1742 CG TYR A 100 8.033 -8.941 -3.256 1.00 0.00 C ATOM 1743 CD1 TYR A 100 7.489 -8.585 -4.496 1.00 0.00 C ATOM 1744 CD2 TYR A 100 7.878 -10.244 -2.771 1.00 0.00 C ATOM 1745 CE1 TYR A 100 6.793 -9.535 -5.253 1.00 0.00 C ATOM 1746 CE2 TYR A 100 7.182 -11.195 -3.525 1.00 0.00 C ATOM 1747 CZ TYR A 100 6.639 -10.841 -4.769 1.00 0.00 C ATOM 1748 OH TYR A 100 5.954 -11.779 -5.516 1.00 0.00 O ATOM 0 H TYR A 100 10.805 -9.383 -2.246 1.00 0.00 H new ATOM 0 HA TYR A 100 9.940 -7.231 -4.148 1.00 0.00 H new ATOM 0 HB2 TYR A 100 8.969 -8.311 -1.436 1.00 0.00 H new ATOM 0 HB3 TYR A 100 8.161 -7.025 -2.310 1.00 0.00 H new ATOM 0 HD1 TYR A 100 7.606 -7.578 -4.868 1.00 0.00 H new ATOM 0 HD2 TYR A 100 8.296 -10.516 -1.813 1.00 0.00 H new ATOM 0 HE1 TYR A 100 6.375 -9.261 -6.210 1.00 0.00 H new ATOM 0 HE2 TYR A 100 7.063 -12.201 -3.150 1.00 0.00 H new ATOM 0 HH TYR A 100 5.940 -12.633 -5.036 1.00 0.00 H new ATOM 1758 N GLU A 101 11.974 -6.005 -2.763 1.00 0.00 N ATOM 1759 CA GLU A 101 12.663 -4.869 -2.051 1.00 0.00 C ATOM 1760 C GLU A 101 11.903 -3.552 -2.288 1.00 0.00 C ATOM 1761 O GLU A 101 11.829 -2.716 -1.407 1.00 0.00 O ATOM 1762 CB GLU A 101 14.082 -4.773 -2.633 1.00 0.00 C ATOM 1763 CG GLU A 101 14.903 -5.980 -2.177 1.00 0.00 C ATOM 1764 CD GLU A 101 16.380 -5.590 -2.091 1.00 0.00 C ATOM 1765 OE1 GLU A 101 16.877 -5.013 -3.044 1.00 0.00 O ATOM 1766 OE2 GLU A 101 16.990 -5.877 -1.073 1.00 0.00 O ATOM 0 H GLU A 101 12.497 -6.420 -3.534 1.00 0.00 H new ATOM 0 HA GLU A 101 12.692 -5.045 -0.976 1.00 0.00 H new ATOM 0 HB2 GLU A 101 14.039 -4.740 -3.722 1.00 0.00 H new ATOM 0 HB3 GLU A 101 14.560 -3.850 -2.305 1.00 0.00 H new ATOM 0 HG2 GLU A 101 14.550 -6.327 -1.206 1.00 0.00 H new ATOM 0 HG3 GLU A 101 14.774 -6.806 -2.876 1.00 0.00 H new ATOM 1773 N LYS A 102 11.343 -3.351 -3.466 1.00 0.00 N ATOM 1774 CA LYS A 102 10.603 -2.081 -3.733 1.00 0.00 C ATOM 1775 C LYS A 102 9.195 -2.373 -4.277 1.00 0.00 C ATOM 1776 O LYS A 102 9.022 -2.595 -5.461 1.00 0.00 O ATOM 1777 CB LYS A 102 11.439 -1.356 -4.792 1.00 0.00 C ATOM 1778 CG LYS A 102 12.837 -1.048 -4.235 1.00 0.00 C ATOM 1779 CD LYS A 102 13.085 0.468 -4.238 1.00 0.00 C ATOM 1780 CE LYS A 102 14.008 0.842 -5.402 1.00 0.00 C ATOM 1781 NZ LYS A 102 14.838 1.965 -4.887 1.00 0.00 N ATOM 0 H LYS A 102 11.370 -4.010 -4.244 1.00 0.00 H new ATOM 0 HA LYS A 102 10.472 -1.489 -2.827 1.00 0.00 H new ATOM 0 HB2 LYS A 102 11.522 -1.973 -5.687 1.00 0.00 H new ATOM 0 HB3 LYS A 102 10.944 -0.431 -5.088 1.00 0.00 H new ATOM 0 HG2 LYS A 102 12.926 -1.437 -3.221 1.00 0.00 H new ATOM 0 HG3 LYS A 102 13.595 -1.549 -4.837 1.00 0.00 H new ATOM 0 HD2 LYS A 102 12.138 1.000 -4.328 1.00 0.00 H new ATOM 0 HD3 LYS A 102 13.534 0.774 -3.293 1.00 0.00 H new ATOM 0 HE2 LYS A 102 14.628 -0.003 -5.701 1.00 0.00 H new ATOM 0 HE3 LYS A 102 13.435 1.144 -6.279 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 15.497 2.278 -5.628 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 14.221 2.757 -4.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 15.377 1.646 -4.057 1.00 0.00 H new ATOM 1795 N LEU A 103 8.183 -2.360 -3.431 1.00 0.00 N ATOM 1796 CA LEU A 103 6.797 -2.622 -3.923 1.00 0.00 C ATOM 1797 C LEU A 103 5.819 -1.590 -3.320 1.00 0.00 C ATOM 1798 O LEU A 103 5.890 -1.284 -2.144 1.00 0.00 O ATOM 1799 CB LEU A 103 6.468 -4.066 -3.482 1.00 0.00 C ATOM 1800 CG LEU A 103 6.096 -4.123 -1.992 1.00 0.00 C ATOM 1801 CD1 LEU A 103 4.590 -3.880 -1.833 1.00 0.00 C ATOM 1802 CD2 LEU A 103 6.453 -5.499 -1.426 1.00 0.00 C ATOM 0 H LEU A 103 8.262 -2.180 -2.430 1.00 0.00 H new ATOM 0 HA LEU A 103 6.709 -2.524 -5.005 1.00 0.00 H new ATOM 0 HB2 LEU A 103 5.643 -4.452 -4.080 1.00 0.00 H new ATOM 0 HB3 LEU A 103 7.327 -4.711 -3.670 1.00 0.00 H new ATOM 0 HG LEU A 103 6.649 -3.355 -1.451 1.00 0.00 H new ATOM 0 HD11 LEU A 103 4.325 -3.920 -0.777 1.00 0.00 H new ATOM 0 HD12 LEU A 103 4.335 -2.899 -2.234 1.00 0.00 H new ATOM 0 HD13 LEU A 103 4.038 -4.648 -2.375 1.00 0.00 H new ATOM 0 HD21 LEU A 103 6.189 -5.538 -0.369 1.00 0.00 H new ATOM 0 HD22 LEU A 103 5.902 -6.269 -1.966 1.00 0.00 H new ATOM 0 HD23 LEU A 103 7.523 -5.672 -1.539 1.00 0.00 H new ATOM 1814 N CYS A 104 4.915 -1.052 -4.111 1.00 0.00 N ATOM 1815 CA CYS A 104 3.951 -0.040 -3.555 1.00 0.00 C ATOM 1816 C CYS A 104 2.544 -0.633 -3.328 1.00 0.00 C ATOM 1817 O CYS A 104 1.835 -0.186 -2.449 1.00 0.00 O ATOM 1818 CB CYS A 104 3.924 1.140 -4.547 1.00 0.00 C ATOM 1819 SG CYS A 104 3.367 0.637 -6.202 1.00 0.00 S ATOM 0 H CYS A 104 4.803 -1.265 -5.102 1.00 0.00 H new ATOM 0 HA CYS A 104 4.279 0.292 -2.570 1.00 0.00 H new ATOM 0 HB2 CYS A 104 3.263 1.918 -4.165 1.00 0.00 H new ATOM 0 HB3 CYS A 104 4.921 1.575 -4.618 1.00 0.00 H new ATOM 0 HG CYS A 104 4.400 0.364 -6.943 1.00 0.00 H new ATOM 1824 N CYS A 105 2.123 -1.634 -4.079 1.00 0.00 N ATOM 1825 CA CYS A 105 0.758 -2.226 -3.839 1.00 0.00 C ATOM 1826 C CYS A 105 0.797 -3.741 -4.117 1.00 0.00 C ATOM 1827 O CYS A 105 1.858 -4.318 -4.261 1.00 0.00 O ATOM 1828 CB CYS A 105 -0.208 -1.574 -4.840 1.00 0.00 C ATOM 1829 SG CYS A 105 -0.024 0.235 -4.926 1.00 0.00 S ATOM 0 H CYS A 105 2.657 -2.061 -4.836 1.00 0.00 H new ATOM 0 HA CYS A 105 0.444 -2.054 -2.810 1.00 0.00 H new ATOM 0 HB2 CYS A 105 -0.039 -1.999 -5.830 1.00 0.00 H new ATOM 0 HB3 CYS A 105 -1.233 -1.817 -4.559 1.00 0.00 H new ATOM 0 HG CYS A 105 1.161 0.530 -5.371 1.00 0.00 H new ATOM 1834 N LEU A 106 -0.352 -4.387 -4.223 1.00 0.00 N ATOM 1835 CA LEU A 106 -0.362 -5.856 -4.524 1.00 0.00 C ATOM 1836 C LEU A 106 -0.625 -6.075 -6.028 1.00 0.00 C ATOM 1837 O LEU A 106 0.060 -6.846 -6.671 1.00 0.00 O ATOM 1838 CB LEU A 106 -1.496 -6.451 -3.682 1.00 0.00 C ATOM 1839 CG LEU A 106 -1.019 -6.665 -2.245 1.00 0.00 C ATOM 1840 CD1 LEU A 106 -2.187 -7.171 -1.397 1.00 0.00 C ATOM 1841 CD2 LEU A 106 0.116 -7.696 -2.221 1.00 0.00 C ATOM 0 H LEU A 106 -1.272 -3.960 -4.114 1.00 0.00 H new ATOM 0 HA LEU A 106 0.591 -6.330 -4.287 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -2.358 -5.784 -3.693 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -1.821 -7.399 -4.112 1.00 0.00 H new ATOM 0 HG LEU A 106 -0.652 -5.721 -1.841 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -1.852 -7.325 -0.371 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -2.991 -6.435 -1.409 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -2.551 -8.114 -1.805 1.00 0.00 H new ATOM 0 HD21 LEU A 106 0.451 -7.844 -1.195 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -0.243 -8.642 -2.625 1.00 0.00 H new ATOM 0 HD23 LEU A 106 0.948 -7.336 -2.826 1.00 0.00 H new ATOM 1853 N ARG A 107 -1.598 -5.386 -6.603 1.00 0.00 N ATOM 1854 CA ARG A 107 -1.870 -5.554 -8.077 1.00 0.00 C ATOM 1855 C ARG A 107 -1.109 -4.494 -8.921 1.00 0.00 C ATOM 1856 O ARG A 107 -1.171 -4.519 -10.136 1.00 0.00 O ATOM 1857 CB ARG A 107 -3.385 -5.378 -8.247 1.00 0.00 C ATOM 1858 CG ARG A 107 -3.780 -5.707 -9.688 1.00 0.00 C ATOM 1859 CD ARG A 107 -5.306 -5.702 -9.814 1.00 0.00 C ATOM 1860 NE ARG A 107 -5.572 -5.788 -11.282 1.00 0.00 N ATOM 1861 CZ ARG A 107 -5.358 -4.755 -12.082 1.00 0.00 C ATOM 1862 NH1 ARG A 107 -4.899 -3.614 -11.620 1.00 0.00 N ATOM 1863 NH2 ARG A 107 -5.605 -4.867 -13.362 1.00 0.00 N ATOM 0 H ARG A 107 -2.207 -4.724 -6.121 1.00 0.00 H new ATOM 0 HA ARG A 107 -1.529 -6.529 -8.424 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -3.917 -6.031 -7.555 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -3.672 -4.355 -8.005 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -3.346 -4.977 -10.371 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -3.384 -6.683 -9.971 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -5.749 -6.544 -9.282 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -5.734 -4.795 -9.388 1.00 0.00 H new ATOM 0 HE ARG A 107 -5.926 -6.660 -11.676 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -4.699 -3.510 -10.625 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -4.742 -2.832 -12.256 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -5.960 -5.746 -13.738 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -5.442 -4.075 -13.984 1.00 0.00 H new ATOM 1877 N CYS A 108 -0.374 -3.586 -8.303 1.00 0.00 N ATOM 1878 CA CYS A 108 0.404 -2.560 -9.095 1.00 0.00 C ATOM 1879 C CYS A 108 1.710 -3.265 -9.502 1.00 0.00 C ATOM 1880 O CYS A 108 2.092 -3.276 -10.652 1.00 0.00 O ATOM 1881 CB CYS A 108 0.661 -1.429 -8.081 1.00 0.00 C ATOM 1882 SG CYS A 108 0.747 0.235 -8.788 1.00 0.00 S ATOM 0 H CYS A 108 -0.279 -3.510 -7.290 1.00 0.00 H new ATOM 0 HA CYS A 108 -0.083 -2.168 -9.988 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -0.130 -1.448 -7.332 1.00 0.00 H new ATOM 0 HB3 CYS A 108 1.597 -1.634 -7.561 1.00 0.00 H new ATOM 0 HG CYS A 108 1.031 0.154 -10.054 1.00 0.00 H new ATOM 1887 N ILE A 109 2.368 -3.913 -8.555 1.00 0.00 N ATOM 1888 CA ILE A 109 3.628 -4.674 -8.892 1.00 0.00 C ATOM 1889 C ILE A 109 3.293 -6.004 -9.602 1.00 0.00 C ATOM 1890 O ILE A 109 4.111 -6.530 -10.333 1.00 0.00 O ATOM 1891 CB ILE A 109 4.366 -4.954 -7.559 1.00 0.00 C ATOM 1892 CG1 ILE A 109 3.506 -5.837 -6.635 1.00 0.00 C ATOM 1893 CG2 ILE A 109 4.666 -3.634 -6.847 1.00 0.00 C ATOM 1894 CD1 ILE A 109 4.408 -6.564 -5.634 1.00 0.00 C ATOM 0 H ILE A 109 2.090 -3.948 -7.574 1.00 0.00 H new ATOM 0 HA ILE A 109 4.252 -4.090 -9.569 1.00 0.00 H new ATOM 0 HB ILE A 109 5.296 -5.476 -7.786 1.00 0.00 H new ATOM 0 HG12 ILE A 109 2.777 -5.224 -6.105 1.00 0.00 H new ATOM 0 HG13 ILE A 109 2.944 -6.560 -7.226 1.00 0.00 H new ATOM 0 HG21 ILE A 109 5.185 -3.836 -5.910 1.00 0.00 H new ATOM 0 HG22 ILE A 109 5.295 -3.012 -7.484 1.00 0.00 H new ATOM 0 HG23 ILE A 109 3.732 -3.112 -6.639 1.00 0.00 H new ATOM 0 HD11 ILE A 109 3.798 -7.188 -4.981 1.00 0.00 H new ATOM 0 HD12 ILE A 109 5.120 -7.190 -6.173 1.00 0.00 H new ATOM 0 HD13 ILE A 109 4.950 -5.833 -5.034 1.00 0.00 H new ATOM 1906 N GLN A 110 2.112 -6.559 -9.391 1.00 0.00 N ATOM 1907 CA GLN A 110 1.760 -7.848 -10.059 1.00 0.00 C ATOM 1908 C GLN A 110 0.510 -7.666 -10.934 1.00 0.00 C ATOM 1909 O GLN A 110 0.010 -6.566 -11.079 1.00 0.00 O ATOM 1910 CB GLN A 110 1.474 -8.821 -8.915 1.00 0.00 C ATOM 1911 CG GLN A 110 2.774 -9.507 -8.491 1.00 0.00 C ATOM 1912 CD GLN A 110 2.482 -10.947 -8.047 1.00 0.00 C ATOM 1913 OE1 GLN A 110 1.476 -11.517 -8.424 1.00 0.00 O ATOM 1914 NE2 GLN A 110 3.322 -11.572 -7.258 1.00 0.00 N ATOM 0 H GLN A 110 1.387 -6.171 -8.788 1.00 0.00 H new ATOM 0 HA GLN A 110 2.556 -8.207 -10.711 1.00 0.00 H new ATOM 0 HB2 GLN A 110 1.040 -8.287 -8.070 1.00 0.00 H new ATOM 0 HB3 GLN A 110 0.744 -9.566 -9.231 1.00 0.00 H new ATOM 0 HG2 GLN A 110 3.482 -9.509 -9.320 1.00 0.00 H new ATOM 0 HG3 GLN A 110 3.239 -8.953 -7.676 1.00 0.00 H new ATOM 0 HE21 GLN A 110 4.168 -11.101 -6.938 1.00 0.00 H new ATOM 0 HE22 GLN A 110 3.130 -12.530 -6.965 1.00 0.00 H new ATOM 2034 N THR A 119 2.296 -5.930 -16.284 1.00 0.00 N ATOM 2035 CA THR A 119 2.045 -5.379 -14.917 1.00 0.00 C ATOM 2036 C THR A 119 2.116 -3.846 -14.949 1.00 0.00 C ATOM 2037 O THR A 119 2.367 -3.262 -15.986 1.00 0.00 O ATOM 2038 CB THR A 119 3.169 -5.949 -14.046 1.00 0.00 C ATOM 2039 OG1 THR A 119 3.573 -7.209 -14.566 1.00 0.00 O ATOM 2040 CG2 THR A 119 2.675 -6.123 -12.608 1.00 0.00 C ATOM 0 HA THR A 119 1.060 -5.647 -14.536 1.00 0.00 H new ATOM 0 HB THR A 119 4.015 -5.261 -14.052 1.00 0.00 H new ATOM 0 HG1 THR A 119 3.103 -7.381 -15.409 1.00 0.00 H new ATOM 0 HG21 THR A 119 3.479 -6.529 -11.994 1.00 0.00 H new ATOM 0 HG22 THR A 119 2.366 -5.156 -12.210 1.00 0.00 H new ATOM 0 HG23 THR A 119 1.827 -6.808 -12.595 1.00 0.00 H new ATOM 2048 N CYS A 120 1.905 -3.184 -13.825 1.00 0.00 N ATOM 2049 CA CYS A 120 1.974 -1.678 -13.831 1.00 0.00 C ATOM 2050 C CYS A 120 3.363 -1.220 -14.309 1.00 0.00 C ATOM 2051 O CYS A 120 4.332 -1.947 -14.181 1.00 0.00 O ATOM 2052 CB CYS A 120 1.724 -1.209 -12.391 1.00 0.00 C ATOM 2053 SG CYS A 120 1.526 0.580 -12.387 1.00 0.00 S ATOM 0 H CYS A 120 1.693 -3.611 -12.923 1.00 0.00 H new ATOM 0 HA CYS A 120 1.231 -1.254 -14.507 1.00 0.00 H new ATOM 0 HB2 CYS A 120 0.832 -1.688 -11.988 1.00 0.00 H new ATOM 0 HB3 CYS A 120 2.557 -1.498 -11.750 1.00 0.00 H new ATOM 0 HG CYS A 120 2.386 1.110 -11.568 1.00 0.00 H new ATOM 2058 N ILE A 121 3.471 -0.035 -14.872 1.00 0.00 N ATOM 2059 CA ILE A 121 4.813 0.438 -15.368 1.00 0.00 C ATOM 2060 C ILE A 121 5.742 0.810 -14.195 1.00 0.00 C ATOM 2061 O ILE A 121 6.942 0.624 -14.284 1.00 0.00 O ATOM 2062 CB ILE A 121 4.531 1.656 -16.284 1.00 0.00 C ATOM 2063 CG1 ILE A 121 5.798 2.023 -17.092 1.00 0.00 C ATOM 2064 CG2 ILE A 121 4.041 2.861 -15.464 1.00 0.00 C ATOM 2065 CD1 ILE A 121 6.893 2.646 -16.205 1.00 0.00 C ATOM 0 H ILE A 121 2.700 0.619 -15.009 1.00 0.00 H new ATOM 0 HA ILE A 121 5.331 -0.348 -15.918 1.00 0.00 H new ATOM 0 HB ILE A 121 3.740 1.383 -16.982 1.00 0.00 H new ATOM 0 HG12 ILE A 121 6.190 1.129 -17.576 1.00 0.00 H new ATOM 0 HG13 ILE A 121 5.532 2.723 -17.884 1.00 0.00 H new ATOM 0 HG21 ILE A 121 3.851 3.702 -16.131 1.00 0.00 H new ATOM 0 HG22 ILE A 121 3.121 2.596 -14.942 1.00 0.00 H new ATOM 0 HG23 ILE A 121 4.803 3.140 -14.737 1.00 0.00 H new ATOM 0 HD11 ILE A 121 7.763 2.887 -16.816 1.00 0.00 H new ATOM 0 HD12 ILE A 121 6.512 3.556 -15.741 1.00 0.00 H new ATOM 0 HD13 ILE A 121 7.180 1.936 -15.429 1.00 0.00 H new ATOM 2077 N CYS A 122 5.220 1.348 -13.109 1.00 0.00 N ATOM 2078 CA CYS A 122 6.132 1.738 -11.971 1.00 0.00 C ATOM 2079 C CYS A 122 6.981 0.538 -11.501 1.00 0.00 C ATOM 2080 O CYS A 122 8.126 0.710 -11.122 1.00 0.00 O ATOM 2081 CB CYS A 122 5.240 2.325 -10.846 1.00 0.00 C ATOM 2082 SG CYS A 122 4.383 1.028 -9.895 1.00 0.00 S ATOM 0 H CYS A 122 4.227 1.531 -12.961 1.00 0.00 H new ATOM 0 HA CYS A 122 6.853 2.492 -12.287 1.00 0.00 H new ATOM 0 HB2 CYS A 122 5.855 2.921 -10.171 1.00 0.00 H new ATOM 0 HB3 CYS A 122 4.503 2.998 -11.284 1.00 0.00 H new ATOM 0 HG CYS A 122 5.154 0.614 -8.933 1.00 0.00 H new ATOM 2087 N ARG A 123 6.458 -0.671 -11.547 1.00 0.00 N ATOM 2088 CA ARG A 123 7.294 -1.854 -11.124 1.00 0.00 C ATOM 2089 C ARG A 123 8.551 -1.940 -12.010 1.00 0.00 C ATOM 2090 O ARG A 123 9.613 -2.310 -11.546 1.00 0.00 O ATOM 2091 CB ARG A 123 6.431 -3.110 -11.319 1.00 0.00 C ATOM 2092 CG ARG A 123 6.838 -4.172 -10.297 1.00 0.00 C ATOM 2093 CD ARG A 123 6.618 -5.564 -10.891 1.00 0.00 C ATOM 2094 NE ARG A 123 7.880 -5.873 -11.633 1.00 0.00 N ATOM 2095 CZ ARG A 123 9.012 -6.119 -10.992 1.00 0.00 C ATOM 2096 NH1 ARG A 123 9.073 -6.103 -9.680 1.00 0.00 N ATOM 2097 NH2 ARG A 123 10.095 -6.384 -11.674 1.00 0.00 N ATOM 0 H ARG A 123 5.509 -0.890 -11.852 1.00 0.00 H new ATOM 0 HA ARG A 123 7.611 -1.759 -10.085 1.00 0.00 H new ATOM 0 HB2 ARG A 123 5.376 -2.861 -11.201 1.00 0.00 H new ATOM 0 HB3 ARG A 123 6.556 -3.497 -12.330 1.00 0.00 H new ATOM 0 HG2 ARG A 123 7.885 -4.044 -10.021 1.00 0.00 H new ATOM 0 HG3 ARG A 123 6.252 -4.058 -9.385 1.00 0.00 H new ATOM 0 HD2 ARG A 123 6.429 -6.301 -10.110 1.00 0.00 H new ATOM 0 HD3 ARG A 123 5.755 -5.577 -11.557 1.00 0.00 H new ATOM 0 HE ARG A 123 7.868 -5.895 -12.653 1.00 0.00 H new ATOM 0 HH11 ARG A 123 8.237 -5.898 -9.133 1.00 0.00 H new ATOM 0 HH12 ARG A 123 9.957 -6.296 -9.208 1.00 0.00 H new ATOM 0 HH21 ARG A 123 10.065 -6.400 -12.693 1.00 0.00 H new ATOM 0 HH22 ARG A 123 10.971 -6.574 -11.187 1.00 0.00 H new ATOM 2111 N VAL A 124 8.445 -1.591 -13.281 1.00 0.00 N ATOM 2112 CA VAL A 124 9.652 -1.650 -14.174 1.00 0.00 C ATOM 2113 C VAL A 124 10.528 -0.404 -13.944 1.00 0.00 C ATOM 2114 O VAL A 124 10.046 0.706 -14.056 1.00 0.00 O ATOM 2115 CB VAL A 124 9.123 -1.664 -15.620 1.00 0.00 C ATOM 2116 CG1 VAL A 124 10.296 -1.744 -16.601 1.00 0.00 C ATOM 2117 CG2 VAL A 124 8.211 -2.879 -15.821 1.00 0.00 C ATOM 0 H VAL A 124 7.586 -1.273 -13.729 1.00 0.00 H new ATOM 0 HA VAL A 124 10.259 -2.531 -13.969 1.00 0.00 H new ATOM 0 HB VAL A 124 8.560 -0.749 -15.803 1.00 0.00 H new ATOM 0 HG11 VAL A 124 9.916 -1.754 -17.623 1.00 0.00 H new ATOM 0 HG12 VAL A 124 10.945 -0.879 -16.463 1.00 0.00 H new ATOM 0 HG13 VAL A 124 10.863 -2.656 -16.416 1.00 0.00 H new ATOM 0 HG21 VAL A 124 7.837 -2.888 -16.845 1.00 0.00 H new ATOM 0 HG22 VAL A 124 8.775 -3.792 -15.633 1.00 0.00 H new ATOM 0 HG23 VAL A 124 7.371 -2.822 -15.129 1.00 0.00 H new ATOM 2127 N PRO A 125 11.792 -0.612 -13.633 1.00 0.00 N ATOM 2128 CA PRO A 125 12.709 0.536 -13.400 1.00 0.00 C ATOM 2129 C PRO A 125 12.905 1.350 -14.691 1.00 0.00 C ATOM 2130 O PRO A 125 12.385 0.998 -15.732 1.00 0.00 O ATOM 2131 CB PRO A 125 14.015 -0.126 -12.959 1.00 0.00 C ATOM 2132 CG PRO A 125 13.942 -1.507 -13.519 1.00 0.00 C ATOM 2133 CD PRO A 125 12.491 -1.898 -13.471 1.00 0.00 C ATOM 0 HA PRO A 125 12.328 1.241 -12.662 1.00 0.00 H new ATOM 0 HB2 PRO A 125 14.882 0.412 -13.342 1.00 0.00 H new ATOM 0 HB3 PRO A 125 14.105 -0.142 -11.873 1.00 0.00 H new ATOM 0 HG2 PRO A 125 14.320 -1.534 -14.541 1.00 0.00 H new ATOM 0 HG3 PRO A 125 14.552 -2.197 -12.936 1.00 0.00 H new ATOM 0 HD2 PRO A 125 12.236 -2.598 -14.266 1.00 0.00 H new ATOM 0 HD3 PRO A 125 12.235 -2.380 -12.528 1.00 0.00 H new ATOM 2141 N ARG A 126 13.649 2.438 -14.631 1.00 0.00 N ATOM 2142 CA ARG A 126 13.863 3.266 -15.871 1.00 0.00 C ATOM 2143 C ARG A 126 14.855 2.572 -16.818 1.00 0.00 C ATOM 2144 O ARG A 126 14.689 2.612 -18.023 1.00 0.00 O ATOM 2145 CB ARG A 126 14.430 4.617 -15.408 1.00 0.00 C ATOM 2146 CG ARG A 126 14.440 5.596 -16.584 1.00 0.00 C ATOM 2147 CD ARG A 126 13.124 6.377 -16.612 1.00 0.00 C ATOM 2148 NE ARG A 126 13.352 7.550 -15.713 1.00 0.00 N ATOM 2149 CZ ARG A 126 14.100 8.574 -16.094 1.00 0.00 C ATOM 2150 NH1 ARG A 126 14.674 8.601 -17.276 1.00 0.00 N ATOM 2151 NH2 ARG A 126 14.276 9.584 -15.281 1.00 0.00 N ATOM 0 H ARG A 126 14.111 2.784 -13.790 1.00 0.00 H new ATOM 0 HA ARG A 126 12.928 3.397 -16.416 1.00 0.00 H new ATOM 0 HB2 ARG A 126 13.826 5.017 -14.593 1.00 0.00 H new ATOM 0 HB3 ARG A 126 15.441 4.486 -15.021 1.00 0.00 H new ATOM 0 HG2 ARG A 126 15.281 6.283 -16.491 1.00 0.00 H new ATOM 0 HG3 ARG A 126 14.573 5.054 -17.520 1.00 0.00 H new ATOM 0 HD2 ARG A 126 12.876 6.697 -17.624 1.00 0.00 H new ATOM 0 HD3 ARG A 126 12.294 5.765 -16.259 1.00 0.00 H new ATOM 0 HE ARG A 126 12.923 7.562 -14.788 1.00 0.00 H new ATOM 0 HH11 ARG A 126 14.548 7.822 -17.922 1.00 0.00 H new ATOM 0 HH12 ARG A 126 15.246 9.401 -17.547 1.00 0.00 H new ATOM 0 HH21 ARG A 126 13.838 9.579 -14.360 1.00 0.00 H new ATOM 0 HH22 ARG A 126 14.851 10.376 -15.568 1.00 0.00 H new ATOM 2165 N ALA A 127 15.887 1.937 -16.293 1.00 0.00 N ATOM 2166 CA ALA A 127 16.877 1.248 -17.201 1.00 0.00 C ATOM 2167 C ALA A 127 16.158 0.202 -18.066 1.00 0.00 C ATOM 2168 O ALA A 127 16.438 0.073 -19.244 1.00 0.00 O ATOM 2169 CB ALA A 127 17.915 0.566 -16.296 1.00 0.00 C ATOM 0 H ALA A 127 16.085 1.866 -15.295 1.00 0.00 H new ATOM 0 HA ALA A 127 17.356 1.962 -17.871 1.00 0.00 H new ATOM 0 HB1 ALA A 127 18.654 0.053 -16.912 1.00 0.00 H new ATOM 0 HB2 ALA A 127 18.412 1.317 -15.683 1.00 0.00 H new ATOM 0 HB3 ALA A 127 17.416 -0.157 -15.651 1.00 0.00 H new ATOM 2175 N GLN A 128 15.224 -0.537 -17.501 1.00 0.00 N ATOM 2176 CA GLN A 128 14.490 -1.559 -18.328 1.00 0.00 C ATOM 2177 C GLN A 128 13.577 -0.837 -19.327 1.00 0.00 C ATOM 2178 O GLN A 128 13.504 -1.211 -20.483 1.00 0.00 O ATOM 2179 CB GLN A 128 13.656 -2.408 -17.354 1.00 0.00 C ATOM 2180 CG GLN A 128 13.316 -3.749 -18.006 1.00 0.00 C ATOM 2181 CD GLN A 128 12.283 -3.532 -19.119 1.00 0.00 C ATOM 2182 OE1 GLN A 128 11.417 -2.690 -18.997 1.00 0.00 O ATOM 2183 NE2 GLN A 128 12.334 -4.259 -20.209 1.00 0.00 N ATOM 0 H GLN A 128 14.942 -0.479 -16.522 1.00 0.00 H new ATOM 0 HA GLN A 128 15.178 -2.191 -18.890 1.00 0.00 H new ATOM 0 HB2 GLN A 128 14.211 -2.571 -16.430 1.00 0.00 H new ATOM 0 HB3 GLN A 128 12.741 -1.880 -17.086 1.00 0.00 H new ATOM 0 HG2 GLN A 128 14.217 -4.204 -18.416 1.00 0.00 H new ATOM 0 HG3 GLN A 128 12.922 -4.438 -17.259 1.00 0.00 H new ATOM 0 HE21 GLN A 128 13.060 -4.968 -20.316 1.00 0.00 H new ATOM 0 HE22 GLN A 128 11.648 -4.116 -20.950 1.00 0.00 H new ATOM 2192 N LEU A 129 12.894 0.206 -18.900 1.00 0.00 N ATOM 2193 CA LEU A 129 12.004 0.952 -19.857 1.00 0.00 C ATOM 2194 C LEU A 129 12.864 1.618 -20.943 1.00 0.00 C ATOM 2195 O LEU A 129 12.485 1.651 -22.099 1.00 0.00 O ATOM 2196 CB LEU A 129 11.260 2.018 -19.037 1.00 0.00 C ATOM 2197 CG LEU A 129 10.166 1.346 -18.204 1.00 0.00 C ATOM 2198 CD1 LEU A 129 9.966 2.122 -16.902 1.00 0.00 C ATOM 2199 CD2 LEU A 129 8.858 1.335 -18.997 1.00 0.00 C ATOM 0 H LEU A 129 12.913 0.568 -17.947 1.00 0.00 H new ATOM 0 HA LEU A 129 11.297 0.283 -20.348 1.00 0.00 H new ATOM 0 HB2 LEU A 129 11.958 2.544 -18.385 1.00 0.00 H new ATOM 0 HB3 LEU A 129 10.821 2.763 -19.701 1.00 0.00 H new ATOM 0 HG LEU A 129 10.461 0.322 -17.974 1.00 0.00 H new ATOM 0 HD11 LEU A 129 9.187 1.643 -16.309 1.00 0.00 H new ATOM 0 HD12 LEU A 129 10.898 2.131 -16.337 1.00 0.00 H new ATOM 0 HD13 LEU A 129 9.670 3.146 -17.130 1.00 0.00 H new ATOM 0 HD21 LEU A 129 8.078 0.857 -18.405 1.00 0.00 H new ATOM 0 HD22 LEU A 129 8.563 2.359 -19.227 1.00 0.00 H new ATOM 0 HD23 LEU A 129 9.000 0.782 -19.925 1.00 0.00 H new ATOM 2211 N GLU A 130 14.025 2.144 -20.589 1.00 0.00 N ATOM 2212 CA GLU A 130 14.894 2.795 -21.635 1.00 0.00 C ATOM 2213 C GLU A 130 15.263 1.773 -22.723 1.00 0.00 C ATOM 2214 O GLU A 130 15.309 2.104 -23.893 1.00 0.00 O ATOM 2215 CB GLU A 130 16.163 3.284 -20.918 1.00 0.00 C ATOM 2216 CG GLU A 130 15.888 4.635 -20.255 1.00 0.00 C ATOM 2217 CD GLU A 130 17.210 5.264 -19.809 1.00 0.00 C ATOM 2218 OE1 GLU A 130 17.693 4.892 -18.752 1.00 0.00 O ATOM 2219 OE2 GLU A 130 17.716 6.107 -20.531 1.00 0.00 O ATOM 0 H GLU A 130 14.401 2.151 -19.641 1.00 0.00 H new ATOM 0 HA GLU A 130 14.374 3.623 -22.116 1.00 0.00 H new ATOM 0 HB2 GLU A 130 16.473 2.556 -20.168 1.00 0.00 H new ATOM 0 HB3 GLU A 130 16.983 3.377 -21.630 1.00 0.00 H new ATOM 0 HG2 GLU A 130 15.375 5.297 -20.953 1.00 0.00 H new ATOM 0 HG3 GLU A 130 15.228 4.504 -19.397 1.00 0.00 H new ATOM 2226 N GLU A 131 15.526 0.531 -22.353 1.00 0.00 N ATOM 2227 CA GLU A 131 15.889 -0.495 -23.400 1.00 0.00 C ATOM 2228 C GLU A 131 14.761 -0.624 -24.437 1.00 0.00 C ATOM 2229 O GLU A 131 15.018 -0.802 -25.613 1.00 0.00 O ATOM 2230 CB GLU A 131 16.083 -1.831 -22.665 1.00 0.00 C ATOM 2231 CG GLU A 131 17.036 -2.721 -23.465 1.00 0.00 C ATOM 2232 CD GLU A 131 16.733 -4.191 -23.169 1.00 0.00 C ATOM 2233 OE1 GLU A 131 16.506 -4.507 -22.013 1.00 0.00 O ATOM 2234 OE2 GLU A 131 16.732 -4.975 -24.103 1.00 0.00 O ATOM 0 H GLU A 131 15.506 0.189 -21.392 1.00 0.00 H new ATOM 0 HA GLU A 131 16.795 -0.203 -23.931 1.00 0.00 H new ATOM 0 HB2 GLU A 131 16.485 -1.654 -21.667 1.00 0.00 H new ATOM 0 HB3 GLU A 131 15.123 -2.331 -22.538 1.00 0.00 H new ATOM 0 HG2 GLU A 131 16.925 -2.524 -24.531 1.00 0.00 H new ATOM 0 HG3 GLU A 131 18.069 -2.492 -23.204 1.00 0.00 H new ATOM 2241 N GLU A 132 13.514 -0.539 -24.018 1.00 0.00 N ATOM 2242 CA GLU A 132 12.384 -0.662 -25.009 1.00 0.00 C ATOM 2243 C GLU A 132 12.488 0.447 -26.066 1.00 0.00 C ATOM 2244 O GLU A 132 12.313 0.197 -27.244 1.00 0.00 O ATOM 2245 CB GLU A 132 11.076 -0.513 -24.214 1.00 0.00 C ATOM 2246 CG GLU A 132 10.638 -1.883 -23.689 1.00 0.00 C ATOM 2247 CD GLU A 132 9.151 -1.841 -23.331 1.00 0.00 C ATOM 2248 OE1 GLU A 132 8.369 -1.441 -24.177 1.00 0.00 O ATOM 2249 OE2 GLU A 132 8.821 -2.209 -22.215 1.00 0.00 O ATOM 0 H GLU A 132 13.231 -0.392 -23.049 1.00 0.00 H new ATOM 0 HA GLU A 132 12.420 -1.621 -25.526 1.00 0.00 H new ATOM 0 HB2 GLU A 132 11.220 0.178 -23.383 1.00 0.00 H new ATOM 0 HB3 GLU A 132 10.298 -0.090 -24.849 1.00 0.00 H new ATOM 0 HG2 GLU A 132 10.820 -2.648 -24.443 1.00 0.00 H new ATOM 0 HG3 GLU A 132 11.227 -2.153 -22.812 1.00 0.00 H new ATOM 2256 N ALA A 133 12.774 1.670 -25.661 1.00 0.00 N ATOM 2257 CA ALA A 133 12.885 2.778 -26.679 1.00 0.00 C ATOM 2258 C ALA A 133 14.026 2.469 -27.659 1.00 0.00 C ATOM 2259 O ALA A 133 13.864 2.597 -28.859 1.00 0.00 O ATOM 2260 CB ALA A 133 13.188 4.071 -25.904 1.00 0.00 C ATOM 0 H ALA A 133 12.932 1.946 -24.692 1.00 0.00 H new ATOM 0 HA ALA A 133 11.964 2.879 -27.253 1.00 0.00 H new ATOM 0 HB1 ALA A 133 13.277 4.902 -26.604 1.00 0.00 H new ATOM 0 HB2 ALA A 133 12.379 4.273 -25.202 1.00 0.00 H new ATOM 0 HB3 ALA A 133 14.123 3.956 -25.356 1.00 0.00 H new ATOM 2266 N ARG A 134 15.177 2.055 -27.165 1.00 0.00 N ATOM 2267 CA ARG A 134 16.317 1.734 -28.100 1.00 0.00 C ATOM 2268 C ARG A 134 15.898 0.640 -29.101 1.00 0.00 C ATOM 2269 O ARG A 134 16.324 0.651 -30.240 1.00 0.00 O ATOM 2270 CB ARG A 134 17.478 1.229 -27.226 1.00 0.00 C ATOM 2271 CG ARG A 134 18.234 2.424 -26.641 1.00 0.00 C ATOM 2272 CD ARG A 134 19.115 3.050 -27.724 1.00 0.00 C ATOM 2273 NE ARG A 134 19.007 4.525 -27.504 1.00 0.00 N ATOM 2274 CZ ARG A 134 19.566 5.106 -26.454 1.00 0.00 C ATOM 2275 NH1 ARG A 134 20.238 4.412 -25.564 1.00 0.00 N ATOM 2276 NH2 ARG A 134 19.450 6.400 -26.293 1.00 0.00 N ATOM 0 H ARG A 134 15.376 1.927 -26.173 1.00 0.00 H new ATOM 0 HA ARG A 134 16.608 2.614 -28.674 1.00 0.00 H new ATOM 0 HB2 ARG A 134 17.095 0.599 -26.423 1.00 0.00 H new ATOM 0 HB3 ARG A 134 18.153 0.613 -27.820 1.00 0.00 H new ATOM 0 HG2 ARG A 134 17.529 3.162 -26.259 1.00 0.00 H new ATOM 0 HG3 ARG A 134 18.847 2.103 -25.799 1.00 0.00 H new ATOM 0 HD2 ARG A 134 20.148 2.712 -27.637 1.00 0.00 H new ATOM 0 HD3 ARG A 134 18.772 2.773 -28.721 1.00 0.00 H new ATOM 0 HE ARG A 134 18.493 5.095 -28.176 1.00 0.00 H new ATOM 0 HH11 ARG A 134 20.338 3.403 -25.674 1.00 0.00 H new ATOM 0 HH12 ARG A 134 20.660 4.882 -24.763 1.00 0.00 H new ATOM 0 HH21 ARG A 134 18.931 6.954 -26.974 1.00 0.00 H new ATOM 0 HH22 ARG A 134 19.878 6.854 -25.486 1.00 0.00 H new ATOM 2290 N LYS A 135 15.067 -0.302 -28.692 1.00 0.00 N ATOM 2291 CA LYS A 135 14.638 -1.384 -29.649 1.00 0.00 C ATOM 2292 C LYS A 135 13.579 -0.857 -30.636 1.00 0.00 C ATOM 2293 O LYS A 135 13.516 -1.307 -31.765 1.00 0.00 O ATOM 2294 CB LYS A 135 14.049 -2.518 -28.796 1.00 0.00 C ATOM 2295 CG LYS A 135 15.184 -3.372 -28.227 1.00 0.00 C ATOM 2296 CD LYS A 135 14.741 -4.835 -28.161 1.00 0.00 C ATOM 2297 CE LYS A 135 14.115 -5.119 -26.794 1.00 0.00 C ATOM 2298 NZ LYS A 135 14.575 -6.490 -26.438 1.00 0.00 N ATOM 0 H LYS A 135 14.674 -0.368 -27.753 1.00 0.00 H new ATOM 0 HA LYS A 135 15.485 -1.731 -30.241 1.00 0.00 H new ATOM 0 HB2 LYS A 135 13.450 -2.104 -27.985 1.00 0.00 H new ATOM 0 HB3 LYS A 135 13.384 -3.134 -29.401 1.00 0.00 H new ATOM 0 HG2 LYS A 135 16.072 -3.278 -28.852 1.00 0.00 H new ATOM 0 HG3 LYS A 135 15.455 -3.018 -27.232 1.00 0.00 H new ATOM 0 HD2 LYS A 135 14.021 -5.044 -28.953 1.00 0.00 H new ATOM 0 HD3 LYS A 135 15.595 -5.492 -28.325 1.00 0.00 H new ATOM 0 HE2 LYS A 135 14.439 -4.389 -26.052 1.00 0.00 H new ATOM 0 HE3 LYS A 135 13.027 -5.067 -26.839 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 14.186 -6.757 -25.511 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 14.247 -7.164 -27.158 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 15.614 -6.507 -26.396 1.00 0.00 H new ATOM 2312 N LYS A 136 12.743 0.086 -30.235 1.00 0.00 N ATOM 2313 CA LYS A 136 11.703 0.608 -31.187 1.00 0.00 C ATOM 2314 C LYS A 136 12.144 1.936 -31.840 1.00 0.00 C ATOM 2315 O LYS A 136 11.312 2.704 -32.287 1.00 0.00 O ATOM 2316 CB LYS A 136 10.439 0.825 -30.345 1.00 0.00 C ATOM 2317 CG LYS A 136 9.911 -0.527 -29.862 1.00 0.00 C ATOM 2318 CD LYS A 136 8.519 -0.344 -29.255 1.00 0.00 C ATOM 2319 CE LYS A 136 8.291 -1.399 -28.170 1.00 0.00 C ATOM 2320 NZ LYS A 136 7.230 -0.828 -27.294 1.00 0.00 N ATOM 0 H LYS A 136 12.738 0.508 -29.306 1.00 0.00 H new ATOM 0 HA LYS A 136 11.538 -0.095 -32.003 1.00 0.00 H new ATOM 0 HB2 LYS A 136 10.663 1.466 -29.492 1.00 0.00 H new ATOM 0 HB3 LYS A 136 9.678 1.335 -30.936 1.00 0.00 H new ATOM 0 HG2 LYS A 136 9.867 -1.230 -30.694 1.00 0.00 H new ATOM 0 HG3 LYS A 136 10.589 -0.951 -29.122 1.00 0.00 H new ATOM 0 HD2 LYS A 136 8.425 0.655 -28.831 1.00 0.00 H new ATOM 0 HD3 LYS A 136 7.758 -0.434 -30.030 1.00 0.00 H new ATOM 0 HE2 LYS A 136 7.977 -2.349 -28.603 1.00 0.00 H new ATOM 0 HE3 LYS A 136 9.205 -1.592 -27.608 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 7.019 -1.495 -26.525 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 7.560 0.072 -26.891 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 6.370 -0.662 -27.854 1.00 0.00 H new ATOM 2334 N GLY A 137 13.435 2.217 -31.920 1.00 0.00 N ATOM 2335 CA GLY A 137 13.897 3.490 -32.564 1.00 0.00 C ATOM 2336 C GLY A 137 13.165 4.702 -31.961 1.00 0.00 C ATOM 2337 O GLY A 137 12.685 5.557 -32.683 1.00 0.00 O ATOM 0 H GLY A 137 14.181 1.618 -31.566 1.00 0.00 H new ATOM 0 HA2 GLY A 137 14.972 3.603 -32.427 1.00 0.00 H new ATOM 0 HA3 GLY A 137 13.716 3.447 -33.638 1.00 0.00 H new ATOM 2341 N THR A 138 13.073 4.789 -30.649 1.00 0.00 N ATOM 2342 CA THR A 138 12.371 5.957 -30.027 1.00 0.00 C ATOM 2343 C THR A 138 12.913 6.228 -28.613 1.00 0.00 C ATOM 2344 O THR A 138 13.901 5.645 -28.205 1.00 0.00 O ATOM 2345 CB THR A 138 10.890 5.557 -29.977 1.00 0.00 C ATOM 2346 OG1 THR A 138 10.140 6.613 -29.393 1.00 0.00 O ATOM 2347 CG2 THR A 138 10.709 4.283 -29.144 1.00 0.00 C ATOM 0 H THR A 138 13.451 4.107 -29.991 1.00 0.00 H new ATOM 0 HA THR A 138 12.524 6.874 -30.596 1.00 0.00 H new ATOM 0 HB THR A 138 10.539 5.367 -30.991 1.00 0.00 H new ATOM 0 HG1 THR A 138 9.193 6.363 -29.361 1.00 0.00 H new ATOM 0 HG21 THR A 138 9.653 4.012 -29.118 1.00 0.00 H new ATOM 0 HG22 THR A 138 11.281 3.471 -29.592 1.00 0.00 H new ATOM 0 HG23 THR A 138 11.064 4.459 -28.128 1.00 0.00 H new ATOM 2355 N GLN A 139 12.279 7.107 -27.862 1.00 0.00 N ATOM 2356 CA GLN A 139 12.770 7.406 -26.484 1.00 0.00 C ATOM 2357 C GLN A 139 11.654 7.160 -25.457 1.00 0.00 C ATOM 2358 O GLN A 139 10.540 6.829 -25.817 1.00 0.00 O ATOM 2359 CB GLN A 139 13.155 8.885 -26.513 1.00 0.00 C ATOM 2360 CG GLN A 139 14.615 9.025 -26.949 1.00 0.00 C ATOM 2361 CD GLN A 139 14.916 10.494 -27.270 1.00 0.00 C ATOM 2362 OE1 GLN A 139 14.446 11.014 -28.264 1.00 0.00 O ATOM 2363 NE2 GLN A 139 15.684 11.195 -26.472 1.00 0.00 N ATOM 0 H GLN A 139 11.448 7.624 -28.148 1.00 0.00 H new ATOM 0 HA GLN A 139 13.609 6.772 -26.198 1.00 0.00 H new ATOM 0 HB2 GLN A 139 12.506 9.427 -27.200 1.00 0.00 H new ATOM 0 HB3 GLN A 139 13.015 9.327 -25.527 1.00 0.00 H new ATOM 0 HG2 GLN A 139 15.277 8.672 -26.158 1.00 0.00 H new ATOM 0 HG3 GLN A 139 14.805 8.404 -27.825 1.00 0.00 H new ATOM 0 HE21 GLN A 139 16.081 10.764 -25.637 1.00 0.00 H new ATOM 0 HE22 GLN A 139 15.885 12.172 -26.686 1.00 0.00 H new ATOM 2372 N VAL A 140 11.941 7.315 -24.179 1.00 0.00 N ATOM 2373 CA VAL A 140 10.885 7.085 -23.142 1.00 0.00 C ATOM 2374 C VAL A 140 11.246 7.802 -21.826 1.00 0.00 C ATOM 2375 O VAL A 140 12.391 8.153 -21.607 1.00 0.00 O ATOM 2376 CB VAL A 140 10.847 5.564 -22.942 1.00 0.00 C ATOM 2377 CG1 VAL A 140 12.214 5.065 -22.457 1.00 0.00 C ATOM 2378 CG2 VAL A 140 9.777 5.215 -21.902 1.00 0.00 C ATOM 0 H VAL A 140 12.854 7.589 -23.816 1.00 0.00 H new ATOM 0 HA VAL A 140 9.917 7.479 -23.451 1.00 0.00 H new ATOM 0 HB VAL A 140 10.608 5.083 -23.891 1.00 0.00 H new ATOM 0 HG11 VAL A 140 12.178 3.985 -22.318 1.00 0.00 H new ATOM 0 HG12 VAL A 140 12.975 5.310 -23.198 1.00 0.00 H new ATOM 0 HG13 VAL A 140 12.462 5.545 -21.510 1.00 0.00 H new ATOM 0 HG21 VAL A 140 9.748 4.135 -21.758 1.00 0.00 H new ATOM 0 HG22 VAL A 140 10.017 5.701 -20.956 1.00 0.00 H new ATOM 0 HG23 VAL A 140 8.804 5.561 -22.251 1.00 0.00 H new ATOM 2388 N SER A 141 10.283 8.023 -20.954 1.00 0.00 N ATOM 2389 CA SER A 141 10.595 8.717 -19.664 1.00 0.00 C ATOM 2390 C SER A 141 9.431 8.572 -18.664 1.00 0.00 C ATOM 2391 O SER A 141 8.466 9.312 -18.722 1.00 0.00 O ATOM 2392 CB SER A 141 10.788 10.176 -20.058 1.00 0.00 C ATOM 2393 OG SER A 141 10.978 10.960 -18.888 1.00 0.00 O ATOM 0 H SER A 141 9.307 7.755 -21.081 1.00 0.00 H new ATOM 0 HA SER A 141 11.472 8.298 -19.170 1.00 0.00 H new ATOM 0 HB2 SER A 141 11.649 10.275 -20.719 1.00 0.00 H new ATOM 0 HB3 SER A 141 9.919 10.533 -20.611 1.00 0.00 H new ATOM 0 HG SER A 141 11.104 11.899 -19.140 1.00 0.00 H new ATOM 2399 N PHE A 142 9.514 7.626 -17.751 1.00 0.00 N ATOM 2400 CA PHE A 142 8.408 7.442 -16.758 1.00 0.00 C ATOM 2401 C PHE A 142 8.789 8.072 -15.403 1.00 0.00 C ATOM 2402 O PHE A 142 9.951 8.262 -15.100 1.00 0.00 O ATOM 2403 CB PHE A 142 8.233 5.916 -16.635 1.00 0.00 C ATOM 2404 CG PHE A 142 7.330 5.570 -15.464 1.00 0.00 C ATOM 2405 CD1 PHE A 142 5.949 5.796 -15.533 1.00 0.00 C ATOM 2406 CD2 PHE A 142 7.890 5.033 -14.302 1.00 0.00 C ATOM 2407 CE1 PHE A 142 5.134 5.477 -14.434 1.00 0.00 C ATOM 2408 CE2 PHE A 142 7.081 4.722 -13.216 1.00 0.00 C ATOM 2409 CZ PHE A 142 5.705 4.938 -13.274 1.00 0.00 C ATOM 0 H PHE A 142 10.296 6.979 -17.654 1.00 0.00 H new ATOM 0 HA PHE A 142 7.484 7.928 -17.071 1.00 0.00 H new ATOM 0 HB2 PHE A 142 7.809 5.518 -17.557 1.00 0.00 H new ATOM 0 HB3 PHE A 142 9.206 5.443 -16.502 1.00 0.00 H new ATOM 0 HD1 PHE A 142 5.512 6.214 -16.428 1.00 0.00 H new ATOM 0 HD2 PHE A 142 8.955 4.859 -14.248 1.00 0.00 H new ATOM 0 HE1 PHE A 142 4.069 5.647 -14.483 1.00 0.00 H new ATOM 0 HE2 PHE A 142 7.522 4.310 -12.320 1.00 0.00 H new ATOM 0 HZ PHE A 142 5.081 4.691 -12.428 1.00 0.00 H new ATOM 2419 N HIS A 143 7.806 8.379 -14.582 1.00 0.00 N ATOM 2420 CA HIS A 143 8.087 8.973 -13.241 1.00 0.00 C ATOM 2421 C HIS A 143 7.174 8.312 -12.197 1.00 0.00 C ATOM 2422 O HIS A 143 7.640 7.682 -11.265 1.00 0.00 O ATOM 2423 CB HIS A 143 7.757 10.459 -13.386 1.00 0.00 C ATOM 2424 CG HIS A 143 8.914 11.169 -14.034 1.00 0.00 C ATOM 2425 ND1 HIS A 143 8.739 12.274 -14.850 1.00 0.00 N ATOM 2426 CD2 HIS A 143 10.268 10.941 -13.995 1.00 0.00 C ATOM 2427 CE1 HIS A 143 9.956 12.668 -15.267 1.00 0.00 C ATOM 2428 NE2 HIS A 143 10.924 11.889 -14.776 1.00 0.00 N ATOM 0 H HIS A 143 6.817 8.240 -14.790 1.00 0.00 H new ATOM 0 HA HIS A 143 9.117 8.825 -12.918 1.00 0.00 H new ATOM 0 HB2 HIS A 143 6.856 10.585 -13.987 1.00 0.00 H new ATOM 0 HB3 HIS A 143 7.551 10.894 -12.408 1.00 0.00 H new ATOM 0 HD2 HIS A 143 10.750 10.148 -13.443 1.00 0.00 H new ATOM 0 HE1 HIS A 143 10.129 13.511 -15.919 1.00 0.00 H new ATOM 0 HE2 HIS A 143 11.928 11.971 -14.938 1.00 0.00 H new ATOM 2436 N GLN A 144 5.875 8.433 -12.360 1.00 0.00 N ATOM 2437 CA GLN A 144 4.925 7.795 -11.401 1.00 0.00 C ATOM 2438 C GLN A 144 3.764 7.162 -12.187 1.00 0.00 C ATOM 2439 O GLN A 144 3.402 7.645 -13.244 1.00 0.00 O ATOM 2440 CB GLN A 144 4.424 8.929 -10.491 1.00 0.00 C ATOM 2441 CG GLN A 144 3.715 10.011 -11.316 1.00 0.00 C ATOM 2442 CD GLN A 144 3.309 11.168 -10.393 1.00 0.00 C ATOM 2443 OE1 GLN A 144 3.657 12.304 -10.644 1.00 0.00 O ATOM 2444 NE2 GLN A 144 2.581 10.931 -9.328 1.00 0.00 N ATOM 0 H GLN A 144 5.434 8.950 -13.121 1.00 0.00 H new ATOM 0 HA GLN A 144 5.391 7.005 -10.812 1.00 0.00 H new ATOM 0 HB2 GLN A 144 3.740 8.527 -9.744 1.00 0.00 H new ATOM 0 HB3 GLN A 144 5.264 9.367 -9.952 1.00 0.00 H new ATOM 0 HG2 GLN A 144 4.374 10.374 -12.104 1.00 0.00 H new ATOM 0 HG3 GLN A 144 2.834 9.594 -11.804 1.00 0.00 H new ATOM 0 HE21 GLN A 144 2.286 9.978 -9.113 1.00 0.00 H new ATOM 0 HE22 GLN A 144 2.309 11.699 -8.715 1.00 0.00 H new ATOM 2453 N CYS A 145 3.184 6.087 -11.695 1.00 0.00 N ATOM 2454 CA CYS A 145 2.052 5.450 -12.459 1.00 0.00 C ATOM 2455 C CYS A 145 0.703 6.063 -12.058 1.00 0.00 C ATOM 2456 O CYS A 145 0.554 6.592 -10.972 1.00 0.00 O ATOM 2457 CB CYS A 145 2.089 3.935 -12.166 1.00 0.00 C ATOM 2458 SG CYS A 145 1.737 3.577 -10.416 1.00 0.00 S ATOM 0 H CYS A 145 3.436 5.631 -10.818 1.00 0.00 H new ATOM 0 HA CYS A 145 2.168 5.628 -13.528 1.00 0.00 H new ATOM 0 HB2 CYS A 145 1.360 3.425 -12.795 1.00 0.00 H new ATOM 0 HB3 CYS A 145 3.070 3.538 -12.428 1.00 0.00 H new ATOM 0 HG CYS A 145 2.578 2.689 -9.977 1.00 0.00 H new ATOM 2463 N VAL A 146 -0.282 6.006 -12.934 1.00 0.00 N ATOM 2464 CA VAL A 146 -1.621 6.605 -12.595 1.00 0.00 C ATOM 2465 C VAL A 146 -2.403 5.725 -11.597 1.00 0.00 C ATOM 2466 O VAL A 146 -3.267 6.222 -10.897 1.00 0.00 O ATOM 2467 CB VAL A 146 -2.396 6.748 -13.921 1.00 0.00 C ATOM 2468 CG1 VAL A 146 -2.695 5.366 -14.522 1.00 0.00 C ATOM 2469 CG2 VAL A 146 -3.712 7.486 -13.659 1.00 0.00 C ATOM 0 H VAL A 146 -0.218 5.576 -13.857 1.00 0.00 H new ATOM 0 HA VAL A 146 -1.489 7.572 -12.111 1.00 0.00 H new ATOM 0 HB VAL A 146 -1.787 7.312 -14.627 1.00 0.00 H new ATOM 0 HG11 VAL A 146 -3.242 5.486 -15.457 1.00 0.00 H new ATOM 0 HG12 VAL A 146 -1.758 4.843 -14.715 1.00 0.00 H new ATOM 0 HG13 VAL A 146 -3.297 4.787 -13.821 1.00 0.00 H new ATOM 0 HG21 VAL A 146 -4.263 7.590 -14.594 1.00 0.00 H new ATOM 0 HG22 VAL A 146 -4.311 6.920 -12.945 1.00 0.00 H new ATOM 0 HG23 VAL A 146 -3.500 8.474 -13.251 1.00 0.00 H new ATOM 2479 N HIS A 147 -2.128 4.430 -11.515 1.00 0.00 N ATOM 2480 CA HIS A 147 -2.894 3.562 -10.538 1.00 0.00 C ATOM 2481 C HIS A 147 -2.851 4.185 -9.129 1.00 0.00 C ATOM 2482 O HIS A 147 -3.876 4.536 -8.574 1.00 0.00 O ATOM 2483 CB HIS A 147 -2.204 2.181 -10.522 1.00 0.00 C ATOM 2484 CG HIS A 147 -2.286 1.515 -11.881 1.00 0.00 C ATOM 2485 ND1 HIS A 147 -3.093 1.985 -12.917 1.00 0.00 N ATOM 2486 CD2 HIS A 147 -1.659 0.396 -12.382 1.00 0.00 C ATOM 2487 CE1 HIS A 147 -2.925 1.160 -13.966 1.00 0.00 C ATOM 2488 NE2 HIS A 147 -2.064 0.177 -13.695 1.00 0.00 N ATOM 0 H HIS A 147 -1.422 3.946 -12.069 1.00 0.00 H new ATOM 0 HA HIS A 147 -3.939 3.474 -10.836 1.00 0.00 H new ATOM 0 HB2 HIS A 147 -1.160 2.296 -10.232 1.00 0.00 H new ATOM 0 HB3 HIS A 147 -2.674 1.545 -9.773 1.00 0.00 H new ATOM 0 HD2 HIS A 147 -0.958 -0.219 -11.837 1.00 0.00 H new ATOM 0 HE1 HIS A 147 -3.427 1.279 -14.915 1.00 0.00 H new ATOM 0 HE2 HIS A 147 -1.766 -0.574 -14.317 1.00 0.00 H new ATOM 2496 N CYS A 148 -1.677 4.334 -8.552 1.00 0.00 N ATOM 2497 CA CYS A 148 -1.576 4.937 -7.192 1.00 0.00 C ATOM 2498 C CYS A 148 -0.602 6.133 -7.205 1.00 0.00 C ATOM 2499 O CYS A 148 -0.201 6.595 -8.257 1.00 0.00 O ATOM 2500 CB CYS A 148 -1.053 3.793 -6.302 1.00 0.00 C ATOM 2501 SG CYS A 148 0.665 3.367 -6.735 1.00 0.00 S ATOM 0 H CYS A 148 -0.787 4.062 -8.970 1.00 0.00 H new ATOM 0 HA CYS A 148 -2.527 5.328 -6.831 1.00 0.00 H new ATOM 0 HB2 CYS A 148 -1.106 4.089 -5.254 1.00 0.00 H new ATOM 0 HB3 CYS A 148 -1.690 2.916 -6.418 1.00 0.00 H new ATOM 0 HG CYS A 148 0.678 2.267 -7.427 1.00 0.00 H new ATOM 2506 N GLY A 149 -0.198 6.617 -6.048 1.00 0.00 N ATOM 2507 CA GLY A 149 0.770 7.753 -6.007 1.00 0.00 C ATOM 2508 C GLY A 149 2.175 7.174 -5.788 1.00 0.00 C ATOM 2509 O GLY A 149 2.777 7.370 -4.750 1.00 0.00 O ATOM 0 H GLY A 149 -0.499 6.272 -5.137 1.00 0.00 H new ATOM 0 HA2 GLY A 149 0.732 8.319 -6.938 1.00 0.00 H new ATOM 0 HA3 GLY A 149 0.513 8.443 -5.203 1.00 0.00 H new ATOM 2513 N CYS A 150 2.696 6.444 -6.755 1.00 0.00 N ATOM 2514 CA CYS A 150 4.057 5.836 -6.592 1.00 0.00 C ATOM 2515 C CYS A 150 5.093 6.642 -7.385 1.00 0.00 C ATOM 2516 O CYS A 150 4.809 7.125 -8.462 1.00 0.00 O ATOM 2517 CB CYS A 150 3.910 4.409 -7.152 1.00 0.00 C ATOM 2518 SG CYS A 150 5.501 3.544 -7.200 1.00 0.00 S ATOM 0 H CYS A 150 2.237 6.246 -7.644 1.00 0.00 H new ATOM 0 HA CYS A 150 4.400 5.831 -5.557 1.00 0.00 H new ATOM 0 HB2 CYS A 150 3.208 3.847 -6.536 1.00 0.00 H new ATOM 0 HB3 CYS A 150 3.489 4.453 -8.156 1.00 0.00 H new ATOM 0 HG CYS A 150 5.443 2.577 -8.067 1.00 0.00 H new ATOM 2523 N ARG A 151 6.301 6.774 -6.876 1.00 0.00 N ATOM 2524 CA ARG A 151 7.348 7.535 -7.631 1.00 0.00 C ATOM 2525 C ARG A 151 8.264 6.547 -8.368 1.00 0.00 C ATOM 2526 O ARG A 151 9.474 6.645 -8.296 1.00 0.00 O ATOM 2527 CB ARG A 151 8.138 8.325 -6.581 1.00 0.00 C ATOM 2528 CG ARG A 151 7.193 9.267 -5.831 1.00 0.00 C ATOM 2529 CD ARG A 151 8.007 10.360 -5.135 1.00 0.00 C ATOM 2530 NE ARG A 151 8.205 11.415 -6.176 1.00 0.00 N ATOM 2531 CZ ARG A 151 7.226 12.241 -6.513 1.00 0.00 C ATOM 2532 NH1 ARG A 151 6.043 12.168 -5.948 1.00 0.00 N ATOM 2533 NH2 ARG A 151 7.436 13.152 -7.429 1.00 0.00 N ATOM 0 H ARG A 151 6.602 6.391 -5.980 1.00 0.00 H new ATOM 0 HA ARG A 151 6.914 8.203 -8.375 1.00 0.00 H new ATOM 0 HB2 ARG A 151 8.617 7.641 -5.881 1.00 0.00 H new ATOM 0 HB3 ARG A 151 8.932 8.897 -7.062 1.00 0.00 H new ATOM 0 HG2 ARG A 151 6.482 9.715 -6.526 1.00 0.00 H new ATOM 0 HG3 ARG A 151 6.612 8.708 -5.097 1.00 0.00 H new ATOM 0 HD2 ARG A 151 7.478 10.755 -4.268 1.00 0.00 H new ATOM 0 HD3 ARG A 151 8.962 9.974 -4.777 1.00 0.00 H new ATOM 0 HE ARG A 151 9.112 11.500 -6.636 1.00 0.00 H new ATOM 0 HH11 ARG A 151 5.862 11.464 -5.233 1.00 0.00 H new ATOM 0 HH12 ARG A 151 5.305 12.815 -6.225 1.00 0.00 H new ATOM 0 HH21 ARG A 151 8.349 13.222 -7.878 1.00 0.00 H new ATOM 0 HH22 ARG A 151 6.687 13.791 -7.694 1.00 0.00 H new ATOM 2547 N GLY A 152 7.694 5.591 -9.076 1.00 0.00 N ATOM 2548 CA GLY A 152 8.525 4.601 -9.809 1.00 0.00 C ATOM 2549 C GLY A 152 9.221 3.667 -8.808 1.00 0.00 C ATOM 2550 O GLY A 152 10.265 3.994 -8.276 1.00 0.00 O ATOM 0 H GLY A 152 6.687 5.463 -9.171 1.00 0.00 H new ATOM 0 HA2 GLY A 152 7.901 4.021 -10.489 1.00 0.00 H new ATOM 0 HA3 GLY A 152 9.268 5.116 -10.418 1.00 0.00 H new ATOM 2554 N CYS A 153 8.657 2.502 -8.547 1.00 0.00 N ATOM 2555 CA CYS A 153 9.305 1.558 -7.582 1.00 0.00 C ATOM 2556 C CYS A 153 9.884 0.341 -8.330 1.00 0.00 C ATOM 2557 O CYS A 153 9.201 -0.303 -9.104 1.00 0.00 O ATOM 2558 CB CYS A 153 8.201 1.154 -6.579 1.00 0.00 C ATOM 2559 SG CYS A 153 6.916 0.132 -7.363 1.00 0.00 S ATOM 0 H CYS A 153 7.784 2.172 -8.959 1.00 0.00 H new ATOM 0 HA CYS A 153 10.145 2.016 -7.059 1.00 0.00 H new ATOM 0 HB2 CYS A 153 8.647 0.604 -5.750 1.00 0.00 H new ATOM 0 HB3 CYS A 153 7.746 2.051 -6.159 1.00 0.00 H new ATOM 0 HG CYS A 153 7.407 -0.449 -8.418 1.00 0.00 H new ATOM 2564 N ALA A 154 11.145 0.027 -8.111 1.00 0.00 N ATOM 2565 CA ALA A 154 11.764 -1.138 -8.811 1.00 0.00 C ATOM 2566 C ALA A 154 12.717 -1.874 -7.857 1.00 0.00 C ATOM 2567 O ALA A 154 13.405 -1.252 -7.070 1.00 0.00 O ATOM 2568 CB ALA A 154 12.538 -0.530 -9.979 1.00 0.00 C ATOM 0 H ALA A 154 11.766 0.530 -7.478 1.00 0.00 H new ATOM 0 HA ALA A 154 11.024 -1.864 -9.148 1.00 0.00 H new ATOM 0 HB1 ALA A 154 13.024 -1.324 -10.546 1.00 0.00 H new ATOM 0 HB2 ALA A 154 11.850 0.011 -10.629 1.00 0.00 H new ATOM 0 HB3 ALA A 154 13.293 0.157 -9.597 1.00 0.00 H new ATOM 2574 N SER A 155 12.763 -3.189 -7.914 1.00 0.00 N ATOM 2575 CA SER A 155 13.678 -3.940 -6.995 1.00 0.00 C ATOM 2576 C SER A 155 14.886 -4.493 -7.769 1.00 0.00 C ATOM 2577 O SER A 155 16.018 -4.316 -7.357 1.00 0.00 O ATOM 2578 CB SER A 155 12.835 -5.081 -6.422 1.00 0.00 C ATOM 2579 OG SER A 155 11.475 -4.672 -6.358 1.00 0.00 O ATOM 0 H SER A 155 12.213 -3.766 -8.550 1.00 0.00 H new ATOM 0 HA SER A 155 14.077 -3.299 -6.208 1.00 0.00 H new ATOM 0 HB2 SER A 155 12.931 -5.969 -7.047 1.00 0.00 H new ATOM 0 HB3 SER A 155 13.193 -5.350 -5.428 1.00 0.00 H new ATOM 0 HG SER A 155 10.931 -5.401 -5.993 1.00 0.00 H new